Dibenzofuran (CED0003825)

Record Information
Version1.0
Creation Date2016-05-19 01:36:58 UTC
Update Date2026-04-16 22:44:24 UTC
SynCED IDCED0003825
Secondary Accession Numbers
  • CHEM004191
Identification
Common NameDibenzofuran
ClassSmall Molecule
Description
Dibenzofuran (C12H8O) is an organic compound with an average molecular weight of 168.19 g/mol. Dibenzofuran belongs to the dibenzofurans, a subclass of benzofurans within the organic compounds. Biologically, it functions as an antioxidant (PMC3179176 ) and an enzyme inhibitor (PMC10646315 ). The compound is present in polyethylene terephthalate, though its presence in polypropylene remains inconclusive. It is found in or released from 28 recorded sources. These include building and construction materials such as tents or canopies; food preservation and food contact materials; and household cleaning and consumer products, including soap detergents, bleaching agents, pipe accessories, perfumes within detergents and soaps, and cigar cigarettes. Additionally, it is associated with electrical and electronic equipment, such as amplifiers, antennas, auxiliary devices, coils, and conductors or conductive bodies characterised by the conductive materials, among 13 other items. Recorded routes of exposure include oral, inhalation, and touch. Regarding health effects, dibenzofuran is associated with cancer (PMC10918910 , PMC5633873 ).
Contaminant TypeNot Available
Chemical Structure
Synonyms
ValueSource
DBFChEBI
Diphenylene oxideChEBI
Chemical FormulaC12H8O
Average Molecular Mass168.191 g/mol
Monoisotopic Mass168.058 g/mol
CAS Registry Number132-64-9
IUPAC Name8-oxatricyclo[7.4.0.0^{2,7}]trideca-1(13),2,4,6,9,11-hexaene
Traditional Name8-oxatricyclo[7.4.0.0^{2,7}]trideca-1(13),2,4,6,9,11-hexaene
SMILESO1C2=CC=CC=C2C2=CC=CC=C12
InChI IdentifierInChI=1S/C12H8O/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11/h1-8H
InChI KeyTXCDCPKCNAJMEE-UHFFFAOYSA-N
Chemical Taxonomy
Description Belongs to the class of organic compounds known as dibenzofurans. Dibenzofurans are compounds containing a dibenzofuran moiety, which consists of two benzene rings fused to a central furan ring.
KingdomOrganic compounds
Super ClassOrganoheterocyclic compounds
ClassBenzofurans
Sub ClassDibenzofurans
Direct ParentDibenzofurans
Alternative Parents
Substituents
  • Dibenzofuran
  • Benzenoid
  • Heteroaromatic compound
  • Furan
  • Oxacycle
  • Organic oxygen compound
  • Hydrocarbon derivative
  • Organooxygen compound
  • Aromatic heteropolycyclic compound
Molecular FrameworkAromatic heteropolycyclic compounds
External Descriptors
Biological Properties
StatusDetected and Not Quantified
OriginNot Available
Cellular LocationsNot Available
Biofluid LocationsNot Available
Tissue LocationsNot Available
ApplicationsNot Available
Biological Roles
Chemical RolesNot Available
Organoleptic EffectsNot Available
Physical Properties
StateNot Available
AppearanceNot Available
Experimental Properties
PropertyValue
Melting PointNot Available
Boiling PointNot Available
SolubilityNot Available
Predicted Properties
PropertyValueSource
Water Solubility0.041 g/LALOGPS
logP3.92ALOGPS
logP3.15ChemAxon
logS-3.6ALOGPS
pKa (Strongest Basic)-3ChemAxon
Physiological Charge0ChemAxon
Hydrogen Acceptor Count0ChemAxon
Hydrogen Donor Count0ChemAxon
Polar Surface Area13.14 ŲChemAxon
Rotatable Bond Count0ChemAxon
Refractivity51.23 m³·mol⁻¹ChemAxon
Polarizability18.35 ųChemAxon
Number of Rings3ChemAxon
BioavailabilityYesChemAxon
Rule of FiveYesChemAxon
Ghose FilterYesChemAxon
Veber's RuleYesChemAxon
MDDR-like RuleNoChemAxon
Spectra
Spectra
Spectrum TypeDescriptionSplash KeyDeposition DateView
Predicted GC-MSPredicted GC-MS Spectrumsplash10-014i-0900000000-96f2f32ec1c36319d0aeNot AvailableView Spectrum
Predicted GC-MSPredicted GC-MS SpectrumNot AvailableNot AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-014i-0900000000-4b7b77d483b46799d32fNot AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-014i-0900000000-f37c24a32a750bdfad54Not AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-014i-1900000000-e67dbd09121f909ceb1dNot AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-014i-0900000000-6dd913ccbb5aea0de100Not AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-014i-0900000000-6dd913ccbb5aea0de100Not AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-014i-0900000000-e9e8cb3eb907f1c30119Not AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-014i-0900000000-625227d32e01bc2d211aNot AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-014i-0900000000-625227d32e01bc2d211aNot AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-014i-0900000000-ade2539a1da18100d09fNot AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-014i-0900000000-806df8264d6d236c4796Not AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-014i-0900000000-806df8264d6d236c4796Not AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-014i-0900000000-69405e1906ed09b28cebNot AvailableView Spectrum
Toxicity Profile
Toxicity Values
Toxicity ValueOrganismDose DescriptorRoute of ExposurePredicted or ExperimentalToxicity RatingReference
753.0 Log mg/kg [420:1300]RatLD50oralpredictedNot AvailableNot Available
Toxicity / Toxin ClassNot Available
Mechanism of ToxicityNot Available
Carcinogenicity (IARC Classification)Not Available
Minimum Risk LevelNot Available
SymptomsNot Available
TreatmentNot Available
Health Effects
Health EffectRelationshipDirectionDescriptionReference
cancerAssociated With?Not AvailableCancer is a group of diseases involving abnormal cell growth with the potential to invade or spread to other parts of the body. Possible signs and symptoms include a lump, abnormal bleeding, prolonged cough, unexplained weight loss, and a change in bowel movements. There are over 100 types of cancers affect humans. The risk of developing certain cancers can be reduced by not smoking, maintaining a healthy weight, not drinking too much alcohol, eating plenty of vegetables, fruits and whole grains, vaccination against certain infectious diseases, not eating too much processed and red meat and avoiding too much sunlight exposure. Cancer is often treated with some combination of radiation therapy, surgery, chemotherapy and targeted therapy. The majority of cancers, some 90–95% of cases, are due to genetic mutations from environmental and lifestyle factors. The remaining 5–10% are due to inherited genetics.PMC10918910 , PMC5633873
cancerAssociated With?increaseCancer is a group of diseases involving abnormal cell growth with the potential to invade or spread to other parts of the body. Possible signs and symptoms include a lump, abnormal bleeding, prolonged cough, unexplained weight loss, and a change in bowel movements. There are over 100 types of cancers affect humans. The risk of developing certain cancers can be reduced by not smoking, maintaining a healthy weight, not drinking too much alcohol, eating plenty of vegetables, fruits and whole grains, vaccination against certain infectious diseases, not eating too much processed and red meat and avoiding too much sunlight exposure. Cancer is often treated with some combination of radiation therapy, surgery, chemotherapy and targeted therapy. The majority of cancers, some 90–95% of cases, are due to genetic mutations from environmental and lifestyle factors. The remaining 5–10% are due to inherited genetics.PMC8709279
breast cancerAssociated With?increaseA breast cancer that has material basis in abnormally proliferating cells derives from epithelial cells. (DO)PMC10246344 , PMC10246344
breast cancerAssociated With?positiveA breast cancer that has material basis in abnormally proliferating cells derives from epithelial cells. (DO)PMC10246344
type 2 diabetes mellitusAssociated With?Not AvailableNot AvailablePMC3396318
diabetes mellitusAssociated With?decreaseA glucose metabolism disease characterized by chronic hyperglycaemia with disturbances of carbohydrate, fat and protein metabolism resulting from defects in insulin secretion, insulin action, or both. (DO)PMC7024247
diabetes mellitusAssociated With?Not AvailableA glucose metabolism disease characterized by chronic hyperglycaemia with disturbances of carbohydrate, fat and protein metabolism resulting from defects in insulin secretion, insulin action, or both. (DO)PMC6801747
liver cancerAssociated With?Not AvailableLiver cancer, also known as hepatic cancer and primary hepatic cancer, is cancer that starts in the liver. Cancer which has spread from elsewhere to the liver, known as liver metastasis, is more common than that which starts in the liver. Symptoms of liver cancer may include a lump or pain in the right side below the rib cage, swelling of the abdomen, yellowish skin, easy bruising, weight loss and weakness.("Adult Primary Liver Cancer Treatment (PDQ®)–Patient Version". NCI. 6 July 2016. Archived from the original on 2 October 2016. Retrieved 29 September 2016) The leading cause of liver cancer is cirrhosis due to hepatitis B, hepatitis C or alcohol.(PMID: 25530442) The most common types of liver cancer are hepatocellular carcinoma (HCC), which makes up 80% of cases, and cholangiocarcinoma.(World Cancer Report 2014. World Health Organization. 2014. pp. Chapter 5.6. ISBN 978-9283204299) Globally, as of 2010, liver cancer resulted in 754,000 deaths, up from 460,000 in 1990, making it the third leading cause of cancer death after lung and stomach.(PMID: 23245604) In 2012, it represented 7% of cancer diagnoses in men, the 5th most diagnosed cancer that year.(World Cancer Report 2014. International Agency for Research on Cancer, World Health Organization. 2014. ISBN 978-92-832-0432-9)PMC12121063
leukemiaAssociated With?Not AvailableA cancer that affects the blood or bone marrow characterized by an abnormal proliferation of blood cells. (DO)PMC12121063
obesityAssociated With?decreaseA disorder characterized by having a high amount of body fat. (NCI CTCAE)PMC7024247
hyperglycemiaAssociated With?decreaseA disorder characterized by laboratory test results that indicate an elevation in the concentration of blood sugar. It is usually an indication of diabetes mellitus or glucose intolerance. (NCI CTCAE)PMC7024247
non-Hodgkin lymphomaAssociated With?increaseNot AvailablePMC5330683
glucose intoleranceAssociated With?increaseA disorder characterized by an inability to properly metabolize glucose. (NCI CTCAE)PMC3339464
larynx cancerAssociated With?increaseNot AvailablePMC12121063
abdominal obesity-metabolic syndromeAssociated With?Not AvailableNot AvailablePMC3396318 , PMC3396318
cardiovascular disorderAssociated With?increaseNot AvailablePMC3339464
cardiovascular disorderAssociated With?decreaseNot AvailablePMC7024247
cardiovascular disorderAssociated With?Not AvailableNot AvailablePMC3396318
skin lesionAssociated With?Not AvailableNot AvailablePMC12646043
DNA DamageAssociated With?Not AvailableNot AvailablePMC6801747
HypercholesterolemiaAssociated With?decreaseNot AvailablePMC7024247
CorrosionAssociated With?Not AvailableNot AvailablePMC9182725
hyperlipidemiaAssociated With?decreaseNot AvailablePMC7024247
fatty liver diseaseAssociated With?Not AvailableNot AvailablePMC5657429
Exposure Sources
Source IDSourceSectorReference
CEDs000010Insecticides?Insecticides are synthetic chemicals designed to control or eliminate insect pests that threaten crops and other agricultural products.Agriculture & land managementPubChem
CEDs000012Fertilizer?Fertilizers, which are often synthesized from chemical compounds such as ammonia, nitrates, and phosphates, are widely used to enhance soil fertility and promote plant growth.Agriculture & land managementPMC6224007
CEDs000013Soil?Soil serves as a critical medium for plant growth and sustains various ecological functions; however, it can become a reservoir for synthetic chemical contamination.Agriculture & land managementPMC7009407 , PMC7009407
CEDs000018Indoor dust?Indoor dust is a complex mixture of particles that accumulates in indoor environments, consisting of materials such as skin flakes, hair, textile fibers, and particles from outdoor sources.Air, dust & atmospheric transportPMC5330683 , PMC4167052
CEDs000048Marine sediment?Marine sediment can serve as a significant reservoir for synthetic chemical contaminants, which may originate from various anthropogenic activities.Aquatic systems & sedimentsPMC12973078
CEDs000476Biosolids?Biosolids are nutrient-rich organic materials derived from the treatment of sewage sludge during wastewater management processes.Wastewater, sanitation & biosolidsPMC2827628 , PMC4167052
CEDs000494Food contact materials?Food contact materials refer to substances and products that are intended to come into contact with food during processing, packaging, or preparation.Food, food processing & cookwareNot Available
CEDs000503Tents Or Canopies?Tents and canopies used in various applications can be a source of synthetic chemical contamination primarily due to the materials from which they are made.Building & ConstructionPubChem
CEDs000505Amplifiers?Amplifiers, commonly used in various electronic devices to enhance signal strength, can be a source of synthetic chemical contamination due to the materials and processes involved in their production and disposal.Electrical & Electronic EquipmentPubChem
CEDs000506Antennas?Antennas, commonly used in communication technologies, can be a source of synthetic chemical contamination through the materials and coatings used in their construction.Electrical & Electronic EquipmentPubChem
CEDs000507Auxiliary Devices?Auxiliary devices, such as capacitors, transformers, and circuit breakers, are integral components in various electronic systems.Electrical & Electronic EquipmentPubChem
CEDs000508Coils?Coils are components used in various electrical and electronic applications, such as transformers, inductors, and motors.Electrical & Electronic EquipmentPubChem
CEDs000511Conductors Or Conductive Bodies Characterised By The Conductive Materials?Conductors, or conductive bodies, are materials that allow the flow of electrical current, typically made from metals such as copper, aluminum, or silver.Electrical & Electronic EquipmentPubChem
CEDs000512Contacts?Contacts in electrical and electronic equipment are components that facilitate the flow of electricity between circuits.Electrical & Electronic EquipmentPubChem
CEDs000514Discharge Lamps?Discharge lamps, including fluorescent and high-intensity discharge (HID) lamps, are commonly used for lighting applications due to their energy efficiency and brightness.Electrical & Electronic EquipmentPubChem
CEDs000517Electric Switches?Electric switches, integral components in numerous devices, can be a source of synthetic chemical contamination due to the materials and manufacturing processes involved in their production.Electrical & Electronic EquipmentPubChem
CEDs000519Electrodes?Electrodes, used in various electrical and electronic applications, can be a source of synthetic chemical contamination due to the materials from which they are constructed and the processes involved in their manufacturing.Electrical & Electronic EquipmentPubChem
CEDs000520Emergency Protective Devices?Emergency protective devices, such as circuit breakers and surge protectors, are essential components in electrical systems designed to prevent damage from overcurrent and surges.Electrical & Electronic EquipmentPubChem
CEDs000521Fixed Capacitors And Their Manufacture?Fixed capacitors are passive electronic components used to store and release electrical energy, playing a critical role in various circuits.Electrical & Electronic EquipmentPubChem
CEDs000524Hybrid Capacitors?Hybrid capacitors are energy storage devices that combine the properties of electrolytic and supercapacitors, utilizing a combination of electrochemical principles to achieve higher energy density and power density.Electrical & Electronic EquipmentPubChem
CEDs000527Magnets?Magnets, commonly used in various electrical and electronic applications, can be a source of synthetic chemical contamination due to the materials used in their production.Electrical & Electronic EquipmentPubChem
CEDs000529Power Cables?Power cables are used to transmit electrical energy and are typically composed of conductive materials, insulation, and protective coatings.Electrical & Electronic EquipmentPubChem
CEDs000534Still Video Cameras?Still video cameras, which capture images in digital format, can be a source of synthetic chemical contamination due to the materials and components used in their production and operation.Electrical & Electronic EquipmentPubChem
CEDs000537Television Systems?Television systems can be a source of synthetic chemical contamination due to the various materials and components used in their manufacture and operation.Electrical & Electronic EquipmentPubChem
CEDs000538Thin Magnetic Films?Thin magnetic films are layers of magnetic material ranging from a few nanometers to several micrometers in thickness, commonly used in applications such as magnetic sensors, data storage devices, and electronic components.Electrical & Electronic EquipmentPubChem
CEDs000539Video Games?Video games, through their production and disposal processes, can be a source of synthetic chemical contamination.Electrical & Electronic EquipmentPubChem
CEDs000545Food Preservation?Food preservation often involves the use of synthetic chemicals, such as preservatives, flavor enhancers, and color additives, to extend shelf life and enhance the sensory qualities of food products.Food, food processing & cookwarePubChem
CEDs000555Bleaching Agents?Bleaching agents are chemical substances used to whiten or lighten materials, often employed in various cleaning products for their stain removal and disinfecting properties.Household cleaning & consumer productsPubChem
CEDs000556Cigar Cigarettes?Cigar cigarettes are a source of synthetic chemical contamination due to the combustion of various tobacco blends and additives.Household cleaning & consumer productsPubChem
CEDs000561Perfumes Within Detergents And Soaps?Perfumes within detergents and soaps are synthetic fragrance compounds added to enhance the sensory experience of cleaning products.Household cleaning & consumer productsPubChem
CEDs000562Pipe Accessories?Pipe accessories, such as fittings, connectors, and seals, are components used in plumbing systems to facilitate the flow of liquids and gases.Household cleaning & consumer productsPubChem
CEDs000563Soap Detergents?Soap detergents are synthetic surfactants designed to enhance the cleaning efficacy of water by reducing surface tension, allowing for better interaction with dirt and grease.Household cleaning & consumer productsPubChem
CEDs000564Soap Dispensers?Soap dispensers, commonly used for dispensing liquid soaps and sanitizers, can become a source of synthetic chemical contamination due to the materials used in their construction and the products they dispense.Household cleaning & consumer productsPubChem
CEDs000569Tobacco Smoke Filters?Tobacco smoke filters are designed to reduce the inhalation of harmful substances in cigarette smoke, including tar and other particulate matter.Household cleaning & consumer productsPubChem
CEDs000578Making Cigars?The process of making cigars involves several steps, including the cultivation of tobacco, fermentation, and the application of various additives to enhance flavor and preservation.Industrial manufacturing & chemical processingPubChem
CEDs000579Manufacture Of Iron Or Steel?The manufacture of iron or steel involves various processes, including smelting, refining, and alloying, which can result in the release of synthetic chemicals and contaminants.Industrial manufacturing & chemical processingPubChem
CEDs000580Manufacture Preparation Of Tobacco Products?The manufacture and preparation of tobacco products involve various processes that can result in the introduction of synthetic chemicals into the environment.Industrial manufacturing & chemical processingPubChem
CEDs000581Paper Making Machines?Paper making machines utilize various synthetic chemicals throughout the production process, including additives, coatings, and bleaching agents.Industrial manufacturing & chemical processingPubChem
CEDs000596Acaricides?Acaricides are synthetic chemicals specifically designed to target and control mite populations that can damage crops and plants.Agriculture & land managementPubChem
CEDs000600Herbicides And Algicides?Herbicides and algicides are synthetic chemicals primarily used to control unwanted plants and algae in various environments.Agriculture & land managementPubChem
CEDs000603Nematocides?Nematocides are synthetic chemicals specifically designed to control nematodes, which are microscopic roundworms that can cause significant damage to crops and plants.Agriculture & land managementPubChem
CEDs000604Pest Attractants?Pest attractants are synthetic chemicals designed to lure specific pests for monitoring or control purposes.Agriculture & land managementPubChem
CEDs000605Pest Repellants?Pest repellents, often formulated from synthetic chemicals, are widely used to protect crops from insect infestations and other pests.Agriculture & land managementPubChem
CEDs000606Plant Growth Regulators?Plant Growth Regulators (PGRs) are synthetic chemicals designed to influence the growth and development of plants.Agriculture & land managementPubChem
CEDs000609Aftershave?Aftershave is a grooming product typically used to soothe and protect the skin following shaving.Personal care & cosmeticsPubChem
CEDs000611Anti Perspirants Or Body Deoderants?Antiperspirants and body deodorants commonly contain synthetic chemicals such as aluminum compounds, parabens, and synthetic fragrances.Personal care & cosmeticsPubChem
CEDs000613Depilatories?Depilatories are products designed to remove unwanted hair through the application of synthetic chemicals that break down the protein structure of hair, facilitating its removal.Personal care & cosmeticsPubChem
CEDs000614Essential Oils Or Perfumes?Essential oils and perfumes are complex mixtures of volatile compounds derived from natural or synthetic sources, commonly used for their aromatic properties.Personal care & cosmeticsPubChem
CEDs000615Eye Makeup Products?Eye makeup products, including mascaras, eyeliners, and eyeshadows, often contain a variety of synthetic chemicals such as pigments, preservatives, and film-forming agents.Personal care & cosmeticsPubChem
CEDs000618Lip Makeup Products?Lip makeup products, such as lipsticks, lip glosses, and lip liners, often contain a variety of synthetic chemicals, including pigments, preservatives, and emollients.Personal care & cosmeticsPubChem
CEDs000630Toys?Toys, particularly those made from synthetic materials such as plastics, can be a source of chemical contamination due to the presence of various additives and compounds used in their production.Recreation & sports surfacesPubChem
CEDs000631Anthraquinone Dyes?Anthraquinone dyes are a class of synthetic organic compounds characterized by their vibrant colors and stability, making them widely used in various applications, particularly in coloring textiles and leather.Textiles, leather & furnishingsPubChem
CEDs000632Apparel?Apparel production often involves the use of various synthetic chemicals, including dyes, finishing agents, and preservatives.Textiles, leather & furnishingsPubChem
CEDs000633Azo Dyes?Azo dyes are synthetic organic compounds characterized by the presence of one or more azo groups (-N=N-), which are widely used for coloring textiles, leather, and furnishings.Textiles, leather & furnishingsPubChem
CEDs000638Decorating Textiles?Decorating textiles often involves the use of synthetic chemicals such as dyes, finishes, and coatings.Textiles, leather & furnishingsPubChem
CEDs000641Foam Dyeing?Foam dyeing is a textile dyeing technique that utilizes a foaming agent to create a dye solution in a gaseous form, allowing for the application of dyes onto fabrics.Textiles, leather & furnishingsPubChem
CEDs000642Footwear?Footwear production often involves the use of various synthetic chemicals, such as adhesives, dyes, and treatments, which can contribute to environmental contamination.Textiles, leather & furnishingsPubChem
CEDs000643Headwear?Headwear made from synthetic materials often incorporates chemicals used in the manufacturing and finishing processes, such as dyes, flame retardants, and water repellents.Textiles, leather & furnishingsPubChem
CEDs000648Nitro Dyes?Nitro dyes are synthetic colorants that contain nitro groups (-NO2) in their chemical structure.Textiles, leather & furnishingsPubChem
CEDs000653Sewing?Sewing processes often involve the use of various synthetic chemicals, which can become sources of contamination in the environment.Textiles, leather & furnishingsPubChem
CEDs000659Transfer Printing?Transfer printing is a process used to apply designs and patterns onto various substrates, commonly utilizing synthetic dyes and inks that can contain hazardous chemicals.Textiles, leather & furnishingsPubChem
CEDs000662Yarns Or Threads?Yarns or threads used in textiles can be a source of synthetic chemical contamination due to the production processes and treatments they undergo.Textiles, leather & furnishingsPubChem
CEDs000666Flame Traps?Flame traps are devices designed to prevent the propagation of flames and explosions by allowing gases to escape while blocking flames.Fire suppression systems & agentsPubChem
CEDs000671Airplanes And Helicopters?Airplanes and helicopters are significant sources of synthetic chemical contamination primarily through the use of aviation fuels, lubricants, and de-icing agents.Aviation & AerospacePubChem
CEDs000678Nitrogenous Fertilisers?Nitrogenous fertilizers are synthetic chemical compounds primarily used to enhance plant growth by supplying essential nitrogen, a crucial nutrient for photosynthesis and protein synthesis.Agriculture & land managementPubChem
CEDs000679Phosphatic Fertilisers?Phosphatic fertilizers are synthetic chemical products primarily composed of phosphorus, which is essential for plant growth.Agriculture & land managementPubChem
CEDs000684Cements?Cements are a composite material primarily used as a binding agent in construction applications, formed by the calcination of limestone and clay minerals at high temperatures.Building & ConstructionPubChem
CEDs000685Ceramics?Ceramics can be a source of synthetic chemical contamination through various additives and processing agents used in their production.Building & ConstructionPubChem
CEDs000686Clay Wares?Clay wares are ceramic products made from natural clay, often utilized in various construction applications such as tiles, bricks, and sanitary ware.Building & ConstructionPubChem
CEDs000688Glass Coatings?Glass coatings are synthetic chemical formulations applied to glass surfaces to enhance properties such as durability, UV resistance, and aesthetic appeal.Building & ConstructionPubChem
CEDs000690Lime?Lime, primarily comprised of calcium oxide (CaO) or calcium hydroxide (Ca(OH)₂), is widely used in various applications, including as a key ingredient in mortars, plasters, and cement.Building & ConstructionPubChem
CEDs000693Silica Glass?Silica glass, primarily composed of silicon dioxide (SiO2), is widely used in various applications, including windows, glass facades, and insulation materials.Building & ConstructionPubChem
CEDs000696Nanotechnology?Nanotechnology involves the manipulation of materials at the molecular or atomic level, typically within the range of 1 to 100 nanometers.Industrial manufacturing & chemical processingPubChem
CEDs000727Printing Machines Or Presses?Printing machines or presses commonly utilize synthetic chemicals such as inks, solvents, and cleaning agents.Paper, pulp & fiber productsPubChem
CEDs000734Coating Compositions?Coating compositions, which include paints, sealants, and varnishes, are formulated with a variety of synthetic chemicals such as solvents, resins, pigments, and additives.Building & ConstructionPubChem
CEDs000735Explosives?Explosives are chemical compounds or mixtures designed to undergo rapid decomposition, releasing energy in the form of gas and heat.Defense & military infrastructurePubChem
CEDs000738Cooling Circuit Water?Cooling circuit water is utilized in various industrial processes to absorb and dissipate heat generated during operations.Industrial manufacturing & chemical processingPubChem
CEDs000739Inks?Inks are complex mixtures composed of pigments or dyes, solvents, resins, and additives used primarily for printing and writing applications.Paper, pulp & fiber productsPubChem
CEDs000740Paper?Paper production involves the processing of wood fibers and the use of various chemicals, which can lead to synthetic chemical contamination.Paper, pulp & fiber productsPubChem
CEDs000741Pigment Pastes?Pigment pastes are concentrated dispersions of pigments used to impart color and properties to materials.Paper, pulp & fiber productsPubChem
CEDs000742Leather Tanning?Leather tanning is a process that transforms raw animal hides into durable leather through the application of various chemicals, including chromium salts, aldehydes, and vegetable tannins.Textiles, leather & furnishingsPubChem
CEDs000743Sludge Treatment?Sludge treatment involves the processing of waste materials generated from wastewater treatment plants, which often contain a variety of organic and inorganic substances.Wastewater, sanitation & biosolidsPubChem
CEDs000744Water, Wastewater, & Sewage Treatment?Water, wastewater, and sewage treatment processes are critical for managing and mitigating pollutants in water systems.Wastewater, sanitation & biosolidsPubChem
CEDs00745Corn OilAgriculture & land managementPMC7997377
CEDs00748Animal FeedAgriculture & land managementPMC6722952 , PMC13120415
CEDs00751FeedAgriculture & land managementPMC7009407 , PMC7009407
CEDs00753Agricultural SoilAgriculture & land managementPMC6224007
CEDs00754BiocharAgriculture & land managementPMC11314058
CEDs00766Soil SamplesAgriculture & land managementPMC13455759
CEDs00775FeedsAgriculture & land managementPMC11491457 , PMC11491457
CEDs00817Feed SamplesAgriculture & land managementPMC11491457
CEDs00876Arable LandAgriculture & land managementPMC6224007
CEDs00883Compound FeedAgriculture & land managementPMC6888492
CEDs00898Forest SoilAgriculture & land managementPMC6224007
CEDs00936Soil ParticlesAgriculture & land managementPMC11767811
CEDs00947Soil SurfacesAgriculture & land managementPMC5330683
CEDs00960Alluvial SoilAgriculture & land managementPMC6224007
CEDs00984Maize SilageAgriculture & land managementPMC7997377
CEDs01000Grass SilageAgriculture & land managementPMC6224007
CEDs01030Garden SoilAgriculture & land managementPMC6224007
CEDs01143DietFood, food processing & cookwarePMC7009407 , PMC4492271
CEDs01144FoodFood, food processing & cookwarePMC7009407 , PMC9523095
CEDs01148MilkFood, food processing & cookwarePMC7009407 , PMC7009407
CEDs01149Rice OilFood, food processing & cookwarePMC3040599 , PMC5382037
CEDs01150ButterFood, food processing & cookwarePMC13120415
CEDs01151FruitsFood, food processing & cookwarePMC7024247
CEDs01152Food ChainFood, food processing & cookwarePMC3425912
CEDs01153Breast MilkFood, food processing & cookwarePMC4845384 , PMC3388438
CEDs01154Human MilkFood, food processing & cookwarePMC7009407 , PMC7009407
CEDs01157FoodsFood, food processing & cookwarePMC9523095
CEDs01160CerealsFood, food processing & cookwarePMC13209661 , PMC7024247
CEDs01162Dairy ProductsFood, food processing & cookwarePMC11996941 , PMC13209661
CEDs01168Food ProductsFood, food processing & cookwarePMC6888492
CEDs01170EggsFood, food processing & cookwarePMC11371234 , PMC11371234
CEDs01171MeatFood, food processing & cookwarePMC9523095 , PMC13209661
CEDs01200VegetablesFood, food processing & cookwarePMC13209661
CEDs01213FoodstuffsFood, food processing & cookwarePMC7009407 , PMC9523095
CEDs01218EggFood, food processing & cookwarePMC6888492
CEDs01219JuicesFood, food processing & cookwarePMC7009407
CEDs01220Processed FoodsFood, food processing & cookwarePMC7009407
CEDs01221Cooking OilsFood, food processing & cookwarePMC7009407
CEDs01226SeafoodFood, food processing & cookwarePMC5981950
CEDs01234Maternal MilkFood, food processing & cookwarePMC3948031 , PMC3948031
CEDs01241FoodstuffFood, food processing & cookwarePMC6224007
CEDs01244BeefFood, food processing & cookwarePMC6888492 , PMC6224007
CEDs01251Pork FatFood, food processing & cookwarePMC6722952
CEDs01268Food ChainsFood, food processing & cookwarePMC6931395
CEDs01295Chicken MeatFood, food processing & cookwarePMC9523095
CEDs01307Pork MeatFood, food processing & cookwarePMC6224007
CEDs01317Sugar Beet PulpFood, food processing & cookwarePMC7997377
CEDs01319Milk ProductsFood, food processing & cookwarePMC11491457
CEDs01349Food of Animal OriginFood, food processing & cookwarePMC9523095 , PMC6224007
CEDs01392PorkFood, food processing & cookwarePMC11491457 , PMC11491457
CEDs01419Chicken EggsFood, food processing & cookwarePMC9995527
CEDs01428Edible OilsFood, food processing & cookwarePMC13209661
CEDs01463Hen EggsFood, food processing & cookwarePMC9995527
CEDs01464Cow MilkFood, food processing & cookwarePMC7997377
CEDs01473Food WebsFood, food processing & cookwarePMC11491457
CEDs01484Cooking OilFood, food processing & cookwarePMC6138766 , PMC3598583
CEDs01497Mothers MilkFood, food processing & cookwarePMC11371234 , PMC11371234
CEDs01561Mother S MilkFood, food processing & cookwarePMC4845384
CEDs01656Bird EggsFood, food processing & cookwarePMC11525409 , PMC11525409
CEDs01737Fruit By-productsFood, food processing & cookwarePMC7024247
CEDs02067LandfillWaste management, landfill & incinerationPMC6224007 , PMC6224007
CEDs02076Fly AshWaste management, landfill & incinerationPMC9566703 , PMC10992316
CEDs02079Plastic WasteWaste management, landfill & incinerationPMC11644497
CEDs02090WasteWaste management, landfill & incinerationPMC12646043 , PMC8709279
CEDs02110Electronic WasteWaste management, landfill & incinerationPMC5330683
CEDs02255WaterAquatic systems & sedimentsPMC13209661 , PMC6888492
CEDs02264SedimentAquatic systems & sedimentsPMC13090284 , PMC11525409
CEDs02278Sediment SurfaceAquatic systems & sedimentsPMC11371234
CEDs02340Water BodyAquatic systems & sedimentsPMC8675782
CEDs02417Freshwater FishAquatic systems & sedimentsPMC11491457
CEDs02504Aquatic BiotaAquatic systems & sedimentsPMC11491457
CEDs02564Elbe riverAquatic systems & sedimentsPMC6224007
CEDs02579Marine AnimalsAquatic systems & sedimentsPMC11491457
CEDs02589AirAir, dust & atmospheric transportPMC10246344 , PMC9213387
CEDs02590DustAir, dust & atmospheric transportPMC5330683 , PMC5330683
CEDs02591AtmosphereAir, dust & atmospheric transportPMC2872352
CEDs02593House DustAir, dust & atmospheric transportPMC5330683 , PMC5330683
CEDs02596Ambient AirAir, dust & atmospheric transportPMC7009407
CEDs02656Atmospheric DepositionAir, dust & atmospheric transportPMC3690775 , PMC11996941
CEDs02712atmospheric PMAir, dust & atmospheric transportPMC7998604
CEDs02954Fossil FuelsEnergy, oil & gasPMC9213387
CEDs02956CoalEnergy, oil & gasPMC9213387 , PMC11767811
CEDs02961Crude OilEnergy, oil & gasPMC6882808
CEDs02962Coal TarEnergy, oil & gasPMC9213387
CEDs03009Waste WaterWastewater, sanitation & biosolidsPMC8789570
CEDs03022Wastewater SamplesWastewater, sanitation & biosolidsPMC11767811
CEDs03043WWTPsWastewater, sanitation & biosolidsPMC4167052 , PMC4167052
CEDs03120Coking WastewaterWastewater, sanitation & biosolidsPMC5036679 , PMC5036679
CEDs03203TextileTextiles, leather & furnishingsPMC12048198
CEDs03216CarpetTextiles, leather & furnishingsPMC5330683
CEDs03250Carpet DustTextiles, leather & furnishingsPMC5330683 , PMC5330683
CEDs03281Vehicle ExhaustAutomotive & urban infrastructurePMC5330683
CEDs03363Organic Solar CellsElectrical & Electronic EquipmentPMC13074071
Pathways
0 pathwaysPathway Source: PathBank

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets
StructureProteinUniProt IDOrganismRelationshipDetails
NAD(P)H dehydrogenase [quinone] 1 structureClick to view 3D structureNAD(P)H dehydrogenase [quinone] 1P05982Rattus norvegicusPredicted (SEA)
Prediction Confidence Score
0.414
Applicability Domain
0.414
Statistical Significance
1.00e-04
Supporting Reference Compounds
1
E-value
0.778492
Poly [ADP-ribose] polymerase tankyrase-1 structureClick to view 3D structurePoly [ADP-ribose] polymerase tankyrase-1O95271HumansPredicted (SEA)
Prediction Confidence Score
0.391
Applicability Domain
0.429
Statistical Significance
0.0017
Supporting Reference Compounds
94
E-value
13.4679
Carbonic anhydrase 9 structureClick to view 3D structureCarbonic anhydrase 9Q16790HumansPredicted (SEA)
Prediction Confidence Score
0.356
Applicability Domain
0.429
Statistical Significance
0.0118
Supporting Reference Compounds
372
E-value
91.5507
Carbonic anhydrase 12 structureClick to view 3D structureCarbonic anhydrase 12O43570HumansPredicted (SEA)
Prediction Confidence Score
0.356
Applicability Domain
0.429
Statistical Significance
0.0112
Supporting Reference Compounds
332
E-value
87.0354
Carbonic anhydrase 1 structureClick to view 3D structureCarbonic anhydrase 1P00915HumansPredicted (SEA)
Prediction Confidence Score
0.356
Applicability Domain
0.429
Statistical Significance
0.0132
Supporting Reference Compounds
407
E-value
103.15
Carbonic anhydrase 2 structureClick to view 3D structureCarbonic anhydrase 2P00918HumansPredicted (SEA)
Prediction Confidence Score
0.356
Applicability Domain
0.429
Statistical Significance
0.0154
Supporting Reference Compounds
472
E-value
119.888
Poly [ADP-ribose] polymerase tankyrase-2 structureClick to view 3D structurePoly [ADP-ribose] polymerase tankyrase-2Q9H2K2HumansPredicted (SEA)
Prediction Confidence Score
0.352
Applicability Domain
0.429
Statistical Significance
0.0025
Supporting Reference Compounds
90
E-value
19.1509
Amine oxidase [flavin-containing] A structureClick to view 3D structureAmine oxidase [flavin-containing] AP21397HumansPredicted (SEA)
Prediction Confidence Score
0.345
Applicability Domain
0.684
Statistical Significance
0.0079
Supporting Reference Compounds
241
E-value
61.7344
Poly [ADP-ribose] polymerase 1 structureClick to view 3D structurePoly [ADP-ribose] polymerase 1P09874HumansPredicted (SEA)
Prediction Confidence Score
0.336
Applicability Domain
0.429
Statistical Significance
0.0051
Supporting Reference Compounds
146
E-value
39.5474
Click to view 3D structureAdenosine receptor A1P25099Rattus norvegicusPredicted (SEA)
Prediction Confidence Score
0.332
Applicability Domain
0.429
Statistical Significance
0.0122
Supporting Reference Compounds
221
E-value
94.7425
Click to view 3D structureVitamin K epoxide reductase complex subunit 1Q6TEK4Rattus norvegicusPredicted (SEA)
Prediction Confidence Score
0.329
Applicability Domain
0.333
Statistical Significance
2.70e-04
Supporting Reference Compounds
2
E-value
2.10193
NAD(P)H dehydrogenase [quinone] 1 structureClick to view 3D structureNAD(P)H dehydrogenase [quinone] 1P15559HumansPredicted (SEA)
Prediction Confidence Score
0.322
Applicability Domain
0.414
Statistical Significance
1.00e-04
Supporting Reference Compounds
8
E-value
0.778492
Mitogen-activated protein kinase 1 structureClick to view 3D structureMitogen-activated protein kinase 1P28482HumansPredicted (SEA)
Prediction Confidence Score
0.32
Applicability Domain
0.414
Statistical Significance
0.0575
Supporting Reference Compounds
763
E-value
447.711
Cytochrome P450 1B1 structureClick to view 3D structureCytochrome P450 1B1Q16678HumansPredicted (SEA)
Prediction Confidence Score
0.317
Applicability Domain
0.429
Statistical Significance
0.0058
Supporting Reference Compounds
88
E-value
45.3861
Click to view 3D structureLong-chain-fatty-acid--CoA ligase 6Q9UKU0HumansPredicted (SEA)
Prediction Confidence Score
0.31
Applicability Domain
0.31
Statistical Significance
0.0011
Supporting Reference Compounds
1
E-value
8.79696
Click to view 3D structureProtein phosphatase EYA3Q99504HumansPredicted (SEA)
Prediction Confidence Score
0.305
Applicability Domain
0.333
Statistical Significance
1.70e-04
Supporting Reference Compounds
4
E-value
1.32344
Vitamin K epoxide reductase complex subunit 1 structureClick to view 3D structureVitamin K epoxide reductase complex subunit 1Q9BQB6HumansPredicted (SEA)
Prediction Confidence Score
0.304
Applicability Domain
0.308
Statistical Significance
4.30e-04
Supporting Reference Compounds
2
E-value
3.34752
Ditrans,polycis-undecaprenyl-diphosphate synthase ((2E,6E)-farnesyl-diphosphate specific) structureClick to view 3D structureDitrans,polycis-undecaprenyl-diphosphate synthase ((2E,6E)-farnesyl-diphosphate specific)P60472Escherichia coli (strain K12)Predicted (SEA)
Prediction Confidence Score
0.302
Applicability Domain
0.302
Statistical Significance
1.10e-04
Supporting Reference Compounds
1
E-value
0.856341
DNA-dependent protein kinase catalytic subunit structureClick to view 3D structureDNA-dependent protein kinase catalytic subunitP78527HumansPredicted (SEA)
Prediction Confidence Score
0.296
Applicability Domain
0.429
Statistical Significance
0.0162
Supporting Reference Compounds
219
E-value
126.271
Amine oxidase [flavin-containing] B structureClick to view 3D structureAmine oxidase [flavin-containing] BP27338HumansPredicted (SEA)
Prediction Confidence Score
0.293
Applicability Domain
0.375
Statistical Significance
0.041
Supporting Reference Compounds
315
E-value
319.415
Androgen receptor structureClick to view 3D structureAndrogen receptorP10275HumansPredicted (SEA)
Prediction Confidence Score
0.292
Applicability Domain
0.429
Statistical Significance
0.0098
Supporting Reference Compounds
146
E-value
76.5258
Carbonic anhydrase 4 structureClick to view 3D structureCarbonic anhydrase 4P22748HumansPredicted (SEA)
Prediction Confidence Score
0.29
Applicability Domain
0.36
Statistical Significance
0.0176
Supporting Reference Compounds
193
E-value
136.859
Protein deacetylase HDAC6 structureClick to view 3D structureProtein deacetylase HDAC6Q9UBN7HumansPredicted (SEA)
Prediction Confidence Score
0.289
Applicability Domain
0.375
Statistical Significance
0.0918
Supporting Reference Compounds
553
E-value
714.422
Cytochrome P450 2C9 structureClick to view 3D structureCytochrome P450 2C9P11712HumansPredicted (SEA)
Prediction Confidence Score
0.289
Applicability Domain
0.414
Statistical Significance
0.182
Supporting Reference Compounds
1245
E-value
1416.93
Broad substrate specificity ATP-binding cassette transporter ABCG2 structureClick to view 3D structureBroad substrate specificity ATP-binding cassette transporter ABCG2Q9UNQ0HumansPredicted (SEA)
Prediction Confidence Score
0.288
Applicability Domain
0.375
Statistical Significance
0.0244
Supporting Reference Compounds
126
E-value
190.03
Aryl hydrocarbon receptor structureClick to view 3D structureAryl hydrocarbon receptorP35869HumansKnownNot Available
Concentrations
Not Available
External Links
DrugBank IDNot Available
HMDB IDNot Available
FooDB IDNot Available
Phenol Explorer IDNot Available
KNApSAcK IDNot Available
BiGG IDNot Available
BioCyc IDNot Available
METLIN IDNot Available
PDB IDNot Available
Wikipedia LinkDibenzofuran
Chemspider IDNot Available
ChEBI ID28145
PubChem Compound ID568
Kegg Compound IDC07729
YMDB IDNot Available
ECMDB IDNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General ReferencesNot Available