AromaDb: A Database of Plant's Aroma Molecules

N-Nonadecanol Details

: IUPAC Name
nonadecane
:Chemical Class
:CAS Registry Number
629-92-5
:Description

:Fragrance Type

Physical and Chemical properties

PUBCHEM ID12401
Molecular Weight (mg/mol)268.521
Molecular FormulaC19H40
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count16
IUPAC Namenonadecane
Canonical SMILESCCCCCCCCCCCCCCCCCCC
PUBCHEM IUPAC INCHIKEYLQERIDTXQFOHKA-UHFFFAOYSA-N
Solubility Level1
Vapour Pressure-4.404

Absorption and Metabolism information

XLOGP3 AA
CACTVS TPSA0
BBB Level4
Absorption Level3
EXT PPB#Prediction1
AlogP989.039
EXT CYP2D6#Prediction1

Toxicological Information

Mouse Female FDANon-Carcinogen
Mouse Male FDAMulti-Carcinogen
Rat Female FDASingle-Carcinogen
Rat Male FDANon-Carcinogen
Ames PredictionNon-Mutagen
Developmental / Reproductive ToxicityToxic
Rat Oral LD5015.5485 g/kg_body_weight
Ocular IrritancyNone
Hepatotoxic#Prediction0
Effected Human Genes

Ecological Information

Aerobic Biodegradability PredictionDegradable

Hazard(s) Identification

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

Compound Biological Activity

Serial No.Cas No Gene SymbolOrganismInteraction Interaction ActionsPubMed Id
Serial No.Activity Name DetailsReferences (PubMed)Other details EPA (U.S)Clinical Trials (U.S. NIH)
1 629-92-5 N-Nonadecanol

Plant Variety and Essential oils

Serial No.Plant NameVariety NameEssential OilCompound Percentage
1 Aromita Acacia caven essential oil

Compound Image


2D Structure

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(External database - ChemAxon)