AromaDb: A Database of Plant's Aroma Molecules

1-Decen-3-ol Details

: IUPAC Name
NA
:Chemical Class
Alcohol
:CAS Registry Number
:Description

:Fragrance Type
mouldy aroma??????

Physical and Chemical properties

PUBCHEM ID170977
Molecular Weight (mg/mol)156.27
Molecular FormulaC10H20O
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count10
IUPAC Name
Canonical SMILESC=CC(O)CCCCCCC
PUBCHEM IUPAC INCHIKEYNSFWLHKFTGZFBP-SNVBAGLBSA-N
Solubility Level3
Vapour Pressure-1.668

Absorption and Metabolism information

XLOGP3 AANA
CACTVS TPSA17.07
BBB Level1
Absorption Level0
EXT PPB#Prediction1
AlogP983.44
EXT CYP2D6#Prediction0

Toxicological Information

Mouse Female FDANon-Carcinogen
Mouse Male FDAMulti-Carcinogen
Rat Female FDANon-Carcinogen
Rat Male FDANon-Carcinogen
Ames PredictionNon-Mutagen
Developmental / Reproductive ToxicityNon-Toxic
Rat Oral LD501.62331
Ocular IrritancyNone
Hepatotoxic#Prediction0
Effected Human GenesNA

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 1-Decen-3-ol

Compound Image


2D Structure

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