AromaDb: A Database of Plant's Aroma Molecules

alpha-Campholenol Details

: IUPAC Name
alpha-Campholenicalcohol
:Chemical Class
:CAS Registry Number
36789-58-9
:Description

:Fragrance Type
camphoraceous aroma??

Physical and Chemical properties

PUBCHEM ID61284
Molecular Weight (mg/mol)154.254
Molecular FormulaC10H18O
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count5
IUPAC Namealpha-Campholenicalcohol
Canonical SMILESC/C1=C/C[C@@H](CCO)C1(C)C
PUBCHEM IUPAC INCHIKEYNPGPPCSBEMHHCR-VIFPVBQESA-N
Solubility Level3
Vapour Pressure-1.398

Absorption and Metabolism information

XLOGP3 AANA
CACTVS TPSA0
BBB Level1
Absorption Level0
EXT PPB#Prediction1
AlogP982.223
EXT CYP2D6#Prediction0

Toxicological Information

Mouse Female FDAMulti-Carcinogen
Mouse Male FDAMulti-Carcinogen
Rat Female FDASingle-Carcinogen
Rat Male FDAMulti-Carcinogen
Ames PredictionNon-Mutagen
Developmental / Reproductive ToxicityToxic
Rat Oral LD501.66416
Ocular IrritancySevere
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 36789-58-9
Serial No.Activity Name DetailsReferences (PubMed)Other details EPA (U.S)Clinical Trials (U.S. NIH)
1 36789-58-9 alpha-Campholenol

Compound Image


2D Structure

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