Ethane-1,1-diol (CED0031345)

Record Information
Version1.0
Creation Date2026-08-22 09:56:57 UTC
Update Date2026-08-22 09:56:57 UTC
Accession NumberCHEM212976
Identification
Common NameEthane-1,1-diol
ClassSmall Molecule
Description
Ethane-1,1-diol is an organic compound with the formula C2H6O2 and an average molecular weight of 62.07 g/mol. Ethane-1,1-diol belongs to the alcohols and polyols, a subclass of organooxygen compounds within the organic compounds. The substance is found in or released from 24 recorded sources across various sectors. Within electrical and electronic equipment, it is associated with antennas, auxiliary devices, communication cables or conductors, cores yokes or armatures, and emergency protective devices, among five other sources. In the category of household cleaning and consumer products, it is linked to non electric simulated smoking devices, other smoking requisites, pipe accessories, soap dispensers, and tobacco pipes, as well as one additional source. Its presence is also noted in food, food processing, and cookware, specifically regarding the preparation of vinegar, the preparation of wine or sparkling wine, the preparation of wort, the processing of meats, and the treatment of hops. Additionally, it is found in building and construction materials, including fencing, floors, stairs, and ramps.
Contaminant TypeNot Available
Chemical Structure
SynonymsNot Available
Chemical FormulaC2H6O2
Average Molecular Mass62.070 g/mol
Monoisotopic Mass62.037 g/mol
CAS Registry Number4433-56-1
IUPAC NameNot Available
Traditional NameNot Available
SMILESNot Available
InChI IdentifierInChI=1S/C2H6O2/c1-2(3)4/h2-4H,1H3
InChI KeyAZHSSKPUVBVXLK-UHFFFAOYSA-N
Chemical Taxonomy
ClassificationNot classified
Biological Properties
StatusDetected and Not Quantified
OriginNot Available
Cellular LocationsNot Available
Biofluid LocationsNot Available
Tissue LocationsNot Available
ApplicationsNot Available
Biological RolesNot Available
Chemical RolesNot Available
Organoleptic EffectsNot Available
Physical Properties
StateNot Available
AppearanceNot Available
Experimental Properties
PropertyValue
Melting PointNot Available
Boiling PointNot Available
SolubilityNot Available
Predicted PropertiesNot Available
Spectra
Spectra
Spectrum TypeDescriptionSplash KeyDeposition DateView
Predicted GC-MSPredicted GC-MS Spectrumsplash10-01ot-9000000000-cc8dbfe3de28ee9e413eNot AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-03di-9000000000-123b47516c16f08813deNot AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-03di-9000000000-883de446dd3927f27592Not AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-0002-9000000000-7ca3897e221702bbe263Not AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-03di-9000000000-e82959a2134ee9295aabNot AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-03di-9000000000-70d1439af83eae234056Not AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-01ox-9000000000-1b7e9fa3462babc67f87Not AvailableView Spectrum
Toxicity Profile
Mechanism of ToxicityNot Available
Carcinogenicity (IARC Classification)Not Available
Minimum Risk LevelNot Available
SymptomsNot Available
TreatmentNot Available
Toxicity Values
Toxicity ValueUnitValue RangeOrganismDose DescriptorRoute of ExposurePredicted or ExperimentalReference
7021.0Log mg/kg[3900:12000]RatLD50oralpredictedNot Available
Health Effects
Health EffectRelationshipDirectionReference
Exposure Sources
Source IDSourceSectorReference
496FencingBuilding & ConstructionNot Available
497FloorsBuilding & ConstructionNot Available
500Stairs And RampsBuilding & ConstructionNot Available
506AntennasElectrical & Electronic EquipmentNot Available
507Auxiliary DevicesElectrical & Electronic EquipmentNot Available
510Communication Cables Or ConductorsElectrical & Electronic EquipmentNot Available
513Cores Yokes Or ArmaturesElectrical & Electronic EquipmentNot Available
520Emergency Protective DevicesElectrical & Electronic EquipmentNot Available
529Power CablesElectrical & Electronic EquipmentNot Available
530Radio Transmission SystemsElectrical & Electronic EquipmentNot Available
537Television SystemsElectrical & Electronic EquipmentNot Available
538Thin Magnetic FilmsElectrical & Electronic EquipmentNot Available
539Video GamesElectrical & Electronic EquipmentNot Available
548Preparation Of VinegarFood, food processing & cookwareNot Available
549Preparation Of Wine Or Sparkling WineFood, food processing & cookwareNot Available
550Preparation Of WortFood, food processing & cookwareNot Available
552Processing MeatsFood, food processing & cookwareNot Available
553Treatment Of HopsFood, food processing & cookwareNot Available
559Non Electric Simulated Smoking DevicesHousehold cleaning & consumer productsNot Available
560Other Smoking RequisitesHousehold cleaning & consumer productsNot Available
562Pipe AccessoriesHousehold cleaning & consumer productsNot Available
564Soap DispensersHousehold cleaning & consumer productsNot Available
566Tobacco PipesHousehold cleaning & consumer productsNot Available
567Tobacco Product CasesHousehold cleaning & consumer productsNot Available
577Watch ChainsHousehold itemsNot Available
578Making CigarsIndustrial manufacturing & chemical processingNot Available
579Manufacture Of Iron Or SteelIndustrial manufacturing & chemical processingNot Available
584BuoysMarine, shipping & aquacultureNot Available
592Marine Propulsion Or SteeringMarine, shipping & aquacultureNot Available
598Fertiliser DistributorsAgriculture & land managementNot Available
604Pest AttractantsAgriculture & land managementNot Available
612Body Washing Or Cleaning ImplementsPersonal care & cosmeticsNot Available
616Face Mask CosmeticsPersonal care & cosmeticsNot Available
619Manicure PedicurePersonal care & cosmeticsNot Available
625Racing SportsRecreation & sports surfacesNot Available
630ToysRecreation & sports surfacesNot Available
633Azo DyesTextiles, leather & furnishingsNot Available
638Decorating TextilesTextiles, leather & furnishingsNot Available
640Embroidering And TuftingTextiles, leather & furnishingsNot Available
647Multicolour DyeingTextiles, leather & furnishingsNot Available
648Nitro DyesTextiles, leather & furnishingsNot Available
650Purses Luggage Hand BagsTextiles, leather & furnishingsNot Available
651Purses Money Bags WalletsTextiles, leather & furnishingsNot Available
652RopesTextiles, leather & furnishingsNot Available
658Touch FastenersTextiles, leather & furnishingsNot Available
Pathways
0 pathways

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets
StructureProteinUniProt IDOrganismRelationshipDetails
3-isopropylmalate dehydrogenase structureClick to view 3D structure3-isopropylmalate dehydrogenaseQ5SIY4Thermus thermophilusPredicted (SEA)1.01204
Click to view 3D structureTaste receptor type 2 member 50P59544HumansPredicted (SEA)92.2513
Click to view 3D structureTaste receptor type 2 member 45P59539HumansPredicted (SEA)92.2513
Click to view 3D structureTaste receptor type 2 member 42Q7RTR8HumansPredicted (SEA)92.2513
Click to view 3D structureTaste receptor type 2 member 41P59536HumansPredicted (SEA)92.2513
Click to view 3D structureTaste receptor type 2 member 7Q9NYW3HumansPredicted (SEA)92.2513
Click to view 3D structureTaste receptor type 2 member 30P59541HumansPredicted (SEA)92.2513
Click to view 3D structureTaste receptor type 2 member 60P59551HumansPredicted (SEA)92.2513
Click to view 3D structureTaste receptor type 2 member 19P59542HumansPredicted (SEA)92.2513
Click to view 3D structureTaste receptor type 2 member 20P59543HumansPredicted (SEA)92.2513
Click to view 3D structureTaste receptor type 2 member 1Q9NYW7HumansPredicted (SEA)92.2513
Click to view 3D structureTaste receptor type 2 member 40P59535HumansPredicted (SEA)92.2513
Click to view 3D structureTaste receptor type 2 member 3Q9NYW6HumansPredicted (SEA)92.2513
Click to view 3D structureTaste receptor type 2 member 13Q9NYV9HumansPredicted (SEA)92.2513
Click to view 3D structureTaste receptor type 2 member 39P59534HumansPredicted (SEA)92.2513
Click to view 3D structureTaste receptor type 2 member 5Q9NYW4HumansPredicted (SEA)92.2513
Click to view 3D structureTaste receptor type 2 member 9Q9NYW1HumansPredicted (SEA)92.2513
Click to view 3D structureTaste receptor type 2 member 43P59537HumansPredicted (SEA)92.2513
Click to view 3D structureBeta-2 adrenergic receptorQ8K4Z4Cavia porcellusPredicted (SEA)2243.61
Click to view 3D structureCAI-1 autoinducer sensor kinase/phosphatase CqsSQ9KM66Vibrio cholerae serotype O1 (strain ATCC 39315 / El Tor Inaba N16961)Predicted (SEA)76.3701
Sodium-dependent noradrenaline transporter structureClick to view 3D structureSodium-dependent noradrenaline transporterP23975HumansPredicted (SEA)7490.5
Click to view 3D structureBeta-1 adrenergic receptorB0FL73Cavia porcellusPredicted (SEA)1947.48
Click to view 3D structureBeta-2 adrenergic receptorQ28044Bos taurusPredicted (SEA)381.539
Prostaglandin G/H synthase 1 structureClick to view 3D structureProstaglandin G/H synthase 1P23219HumansPredicted (SEA)6403.95
Beta-2 adrenergic receptor structureClick to view 3D structureBeta-2 adrenergic receptorP07550HumansPredicted (SEA)7369.67
Concentrations
Not Available
External Links
IdentifiersNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General ReferencesNot Available