4-ethenylcyclohexene-1-carbaldehyde (CED0314915)

Record Information
Version1.0
Creation Date2026-09-01 15:18:54 UTC
Update Date2026-09-01 15:18:54 UTC
Accession NumberCHEM360844
Identification
Common Name4-ethenylcyclohexene-1-carbaldehyde
ClassSmall Molecule
Description
4-ethenylcyclohexene-1-carbaldehyde is a chemical compound with the formula C9H12O. It has an average molecular weight of 136.19 g/mol.
Contaminant TypeNot Available
Chemical Structure
MOLSDFPDBSMILESInChI
SynonymsNot Available
Chemical FormulaC9H12O
Average Molecular MassNot Available
Monoisotopic Mass136.089 g/mol
CAS Registry Number1049017-68-6
IUPAC NameNot Available
Traditional NameNot Available
SMILESC=CC1CCC(=CC1)C=O
InChI IdentifierInChI=1S/C9H12O/c1-2-8-3-5-9(7-10)6-4-8/h2,5,7-8H,1,3-4,6H2
InChI KeyYQYKLWIDPWLECV-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
2326.0Log mg/kg[1300:4100]RatLD50oralpredictedNot Available
Health Effects
Health EffectRelationshipDirectionReference
Exposure Sources
Source IDSourceSectorReference
561Perfumes Within Detergents And SoapsHousehold cleaning & consumer productsNot Available
563Soap DetergentsHousehold cleaning & consumer productsNot Available
611Anti Perspirants Or Body DeoderantsPersonal care & cosmeticsNot Available
614Essential Oils Or PerfumesPersonal care & cosmeticsNot Available
Pathways
0 pathways

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets
StructureProteinUniProt IDOrganismRelationshipDetails
5-hydroxytryptamine receptor 1A structureClick to view 3D structure5-hydroxytryptamine receptor 1AP08908HumansPredicted (SEA)7318.99
Ornithine aminotransferase, mitochondrial structureClick to view 3D structureOrnithine aminotransferase, mitochondrialP04181HumansPredicted (SEA)58.2312
Click to view 3D structureTransient receptor potential cation channel subfamily M member 2E9PTA2Rattus norvegicusPredicted (SEA)26.5466
Alcohol dehydrogenase 1A structureClick to view 3D structureAlcohol dehydrogenase 1AP07327HumansPredicted (SEA)20.0072
Click to view 3D structureProline racemaseQ9L4Q3Clostridium sticklandiiPredicted (SEA)8.95266
Click to view 3D structureMu-type opioid receptorP33535Rattus norvegicusPredicted (SEA)5319.2
D(3) dopamine receptor structureClick to view 3D structureD(3) dopamine receptorP35462HumansPredicted (SEA)7574.65
5-hydroxytryptamine receptor 1B structureClick to view 3D structure5-hydroxytryptamine receptor 1BP28222HumansPredicted (SEA)7386.72
D(4) dopamine receptor structureClick to view 3D structureD(4) dopamine receptorP21917HumansPredicted (SEA)7463.87
Click to view 3D structureKappa-type opioid receptorP41144Cavia porcellusPredicted (SEA)5949.7
Click to view 3D structureDelta-type opioid receptorP33533Rattus norvegicusPredicted (SEA)5775.56
Click to view 3D structurePeptidyl-prolyl cis-trans isomerase MipQ9Z7P3Chlamydia pneumoniaePredicted (SEA)251.531
All-trans-retinol dehydrogenase [NAD(+)] ADH1B structureClick to view 3D structureAll-trans-retinol dehydrogenase [NAD(+)] ADH1BP00325HumansPredicted (SEA)6.07224
Click to view 3D structureD(3) dopamine receptorP19020Rattus norvegicusPredicted (SEA)6552.41
Succinate-semialdehyde dehydrogenase, mitochondrial structureClick to view 3D structureSuccinate-semialdehyde dehydrogenase, mitochondrialP51649HumansPredicted (SEA)151.417
Click to view 3D structureD(2) dopamine receptorP20288Bos taurusPredicted (SEA)5415.58
Androgen receptor structureClick to view 3D structureAndrogen receptorP10275HumansPredicted (SEA)7054.46
Kappa-type opioid receptor structureClick to view 3D structureKappa-type opioid receptorP41145HumansPredicted (SEA)7706.22
Delta-type opioid receptor structureClick to view 3D structureDelta-type opioid receptorP32300Mus musculusPredicted (SEA)5757.03
Click to view 3D structure4-galactosyl-N-acetylglucosaminide 3-alpha-L-fucosyltransferase FUT5Q11128HumansPredicted (SEA)46.9431
Click to view 3D structureSodium-dependent serotonin transporterP31652Rattus norvegicusPredicted (SEA)7370.38
All-trans-retinol dehydrogenase [NAD(+)] ADH4 structureClick to view 3D structureAll-trans-retinol dehydrogenase [NAD(+)] ADH4P08319HumansPredicted (SEA)14.1686
Click to view 3D structureD(2) dopamine receptorP61169RatPredicted (SEA)5803.35
Click to view 3D structure5-hydroxytryptamine receptor 1AP19327Rattus norvegicusPredicted (SEA)6547.51
D(2) dopamine receptor structureClick to view 3D structureD(2) dopamine receptorP14416HumansPredicted (SEA)7352.55
Concentrations
Not Available
External Links
IdentifiersNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General ReferencesNot Available