AromaDb: A Database of Plant's Aroma Molecules

9-Decenol Details

: IUPAC Name
dec-9-en-1-ol
:Chemical Class
Alcohol
:CAS Registry Number
13019-22-2
:Description

:Fragrance Type
fruity

Physical and Chemical properties

PUBCHEM ID25612
Molecular Weight (mg/mol)156.265
Molecular FormulaC10H20O
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count8
IUPAC Namedec-9-en-1-ol
Canonical SMILESC=CCCCCCCCCO
PUBCHEM IUPAC INCHIKEYQGFSQVPRCWJZQK-UHFFFAOYSA-N
Solubility Level3
Vapour Pressure

Absorption and Metabolism information

XLOGP3 AA
CACTVS TPSA20.2
BBB Level1
Absorption Level0
EXT PPB#Prediction1
AlogP983.317
EXT CYP2D6#Prediction0

Toxicological Information

Mouse Female FDAMulti-Carcinogen
Mouse Male FDAMulti-Carcinogen
Rat Female FDASingle-Carcinogen
Rat Male FDANon-Carcinogen
Ames PredictionNon-Mutagen
Developmental / Reproductive ToxicityNon-Toxic
Rat Oral LD501.3703 g/kg_body_weight
Ocular IrritancyNone
Hepatotoxic#Prediction0
Effected Human Genes

Ecological Information

Aerobic Biodegradability PredictionDegradable

Hazard(s) Identification

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

Compound Biological Activity

Serial No.Cas No Gene SymbolOrganismInteraction Interaction ActionsPubMed Id
1 13019-22-2
Serial No.Activity Name DetailsReferences (PubMed)Other details EPA (U.S)Clinical Trials (U.S. NIH)
1 13019-22-2 9-Decenol

Compound Image


2D Structure

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