AromaDb: A Database of Plant's Aroma Molecules

Z-2-Dodecenol Details

: IUPAC Name
(Z)-dodec-2-en-1-ol
:Chemical Class
Alcohol
:CAS Registry Number
:Description

:Fragrance Type

Physical and Chemical properties

PUBCHEM ID5364955
Molecular Weight (mg/mol)184.318
Molecular FormulaC12H24O
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count9
IUPAC Name(Z)-dodec-2-en-1-ol
Canonical SMILESCCCCCCCCC/C=C/CO
PUBCHEM IUPAC INCHIKEYMLRYPOCSLBIUHY-KHPPLWFESA-N
Solubility Level3
Vapour Pressure-2.736

Absorption and Metabolism information

XLOGP3 AA4.6
CACTVS TPSA20.2
BBB Level0
Absorption Level0
EXT PPB#Prediction1
AlogP984.31
EXT CYP2D6#Prediction0

Toxicological Information

Mouse Female FDANon-Carcinogen
Mouse Male FDAMulti-Carcinogen
Rat Female FDASingle-Carcinogen
Rat Male FDANon-Carcinogen
Ames PredictionNon-Mutagen
Developmental / Reproductive ToxicityNon-Toxic
Rat Oral LD504.24874 g/kg_body_weight
Ocular IrritancyNone
Hepatotoxic#Prediction0
Effected Human Genes

Ecological Information

Aerobic Biodegradability PredictionDegradable

Hazard(s) Identification

Physical hazardsnot classified
Health hazards Moderate
Environmental hazardsnot classified
About Table Headings

Compound Biological Activity

Serial No.Cas No Gene SymbolOrganismInteraction Interaction ActionsPubMed Id
1
Serial No.Activity Name DetailsReferences (PubMed)Other details EPA (U.S)Clinical Trials (U.S. NIH)
1 Z-2-Dodecenol

Plant Variety and Essential oils

Serial No.Plant NameVariety NameEssential OilCompound Percentage
1 Gurmari Gymnema sylvestre essential oil

Compound Image


2D Structure

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(External database - ChemAxon)