1,8-Nonadiene (CED0027175)

Record Information
Version1.0
Creation Date2026-04-04 02:07:09 UTC
Update Date2026-08-25 13:25:40 UTC
Accession NumberCHEM070542
Identification
Common Name1,8-Nonadiene
ClassSmall Molecule
Description
1,8-Nonadiene is an organic compound with the chemical formula C9H16 and an average molecular weight of 124.23 g/mol. 1,8-Nonadiene belongs to the olefins, a subclass of unsaturated hydrocarbons within the organic compounds. This compound has been identified in or released from three recorded sources. These include power cables used in electrical and electronic equipment, as well as food, food processing and cookware, specifically in the processing of meats and fermentation processes for beer.
Contaminant TypeNot Available
Chemical Structure
MOLSDFPDBSMILESInChI
SynonymsNot Available
Chemical FormulaC9H16
Average Molecular Mass124.227 g/mol
Monoisotopic Mass124.125 g/mol
CAS Registry Number4900-30-5
IUPAC NameNot Available
Traditional NameNot Available
SMILESC=CCCCCCC=C
InChI IdentifierInChI=1S/C9H16/c1-3-5-7-9-8-6-4-2/h3-4H,1-2,5-9H2
InChI KeyVJHGSLHHMIELQD-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
SpectraNot Available
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
8831.0Log mg/kg[5000:16000]RatLD50oralpredictedNot Available
Health Effects
Health EffectRelationshipDirectionReference
Exposure Sources
Source IDSourceSectorReference
529Power CablesElectrical & Electronic EquipmentNot Available
544Fermentation Processes For BeerFood, food processing & cookwareNot Available
552Processing MeatsFood, food processing & cookwareNot Available
652RopesTextiles, leather & furnishingsNot Available
Pathways
0 pathways

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets
StructureProteinUniProt IDOrganismRelationshipDetails
Click to view 3D structureSeed linoleate 9S-lipoxygenaseP24095Glycine maxPredicted (SEA)0.311397
Peroxisome proliferator-activated receptor gamma structureClick to view 3D structurePeroxisome proliferator-activated receptor gammaP37231HumansPredicted (SEA)2982.64
Peroxisome proliferator-activated receptor alpha structureClick to view 3D structurePeroxisome proliferator-activated receptor alphaQ07869HumansPredicted (SEA)2949.47
Click to view 3D structureMitochondrial 2-oxodicarboxylate carrierQ9BQT8HumansPredicted (SEA)0.155698
Peroxisome proliferator-activated receptor delta structureClick to view 3D structurePeroxisome proliferator-activated receptor deltaQ03181HumansPredicted (SEA)2809.73
Click to view 3D structureCytochrome P450 2C23P24470Rattus norvegicusPredicted (SEA)21.4864
Transient receptor potential cation channel subfamily A member 1 structureClick to view 3D structureTransient receptor potential cation channel subfamily A member 1O75762HumansPredicted (SEA)2235.44
Click to view 3D structureEsteraseA3QR02Chilo suppressalisPredicted (SEA)15.4141
Click to view 3D structureTransient receptor potential cation channel subfamily V member 2Q9WUD2Rattus norvegicusPredicted (SEA)204.899
Cannabinoid receptor 1 structureClick to view 3D structureCannabinoid receptor 1P21554HumansPredicted (SEA)6964.24
Click to view 3D structureCannabinoid receptor 1P20272Rattus norvegicusPredicted (SEA)4186.42
Click to view 3D structurePeroxisomal N(1)-acetyl-spermine/spermidine oxidaseQ8C0L6Mus musculusPredicted (SEA)1.71268
Click to view 3D structureMu-type opioid receptorP42866Mus musculusPredicted (SEA)3643.81
Cannabinoid receptor 2 structureClick to view 3D structureCannabinoid receptor 2P34972HumansPredicted (SEA)6981.36
Click to view 3D structureCannabinoid receptor 1P47746Mus musculusPredicted (SEA)2881.59
Click to view 3D structureDipeptidase 1P22412Sus scrofaPredicted (SEA)30.6726
All-trans-retinol dehydrogenase [NAD(+)] ADH7 structureClick to view 3D structureAll-trans-retinol dehydrogenase [NAD(+)] ADH7P40394HumansPredicted (SEA)70.0643
Click to view 3D structureFatty-acid amide hydrolase 1O00519HumansPredicted (SEA)6756.38
Tyrosine-protein phosphatase non-receptor type 1 structureClick to view 3D structureTyrosine-protein phosphatase non-receptor type 1P18031HumansPredicted (SEA)6274.96
Click to view 3D structureDelta-type opioid receptorP32300Mus musculusPredicted (SEA)5561.7
Transient receptor potential cation channel subfamily V member 1 structureClick to view 3D structureTransient receptor potential cation channel subfamily V member 1Q8NER1HumansPredicted (SEA)7224.64
Click to view 3D structure1-phosphatidylinositol 4,5-bisphosphate phosphodiesterase gamma-1P08487Bos taurusPredicted (SEA)560.281
Fatty acid-binding protein, adipocyte structureClick to view 3D structureFatty acid-binding protein, adipocyteP15090HumansPredicted (SEA)4199.19
Click to view 3D structureCannabinoid receptor 2P47936Mus musculusPredicted (SEA)5279.03
Click to view 3D structureLysophosphatidic acid receptor 3Q9UBY5HumansPredicted (SEA)3081.66
Concentrations
Not Available
External Links
IdentifiersNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General ReferencesNot Available