AromaDb: A Database of Plant's Aroma Molecules

Nonanol Details

: IUPAC Name
nonan-1-ol
:Chemical Class
:CAS Registry Number
143-08-8
:Description

:Fragrance Type

Physical and Chemical properties

PUBCHEM ID8914
Molecular Weight (mg/mol)144.255
Molecular FormulaC9H20O
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count7
IUPAC Namenonan-1-ol
Canonical SMILESCCCCCCCCCO
PUBCHEM IUPAC INCHIKEYZWRUINPWMLAQRD-UHFFFAOYSA-N
Solubility Level3
Vapour Pressure-1.601

Absorption and Metabolism information

XLOGP3 AA
CACTVS TPSA20.2
BBB Level1
Absorption Level0
EXT PPB#Prediction1
AlogP983.251
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 LD502.90401 g/kg_body_weight
Ocular IrritancySevere
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
1 143-08-8 AKR1B8 Rattus norvegicus [AKR1B8 protein co-treated with NADP] affects the oxidation of 1-nonanol affects^cotreatment|affects^oxidation 18845131
2 143-08-8 AKR1B8 Rattus norvegicus [AKR1B8 protein co-treated with NADP] affects the oxidation of 1-nonanol affects^cotreatment|affects^oxidation 18845131
3 143-08-8 NR1I3 Homo sapiens 1-nonanol binds to and results in increased activity of NR1I3 protein alternative form affects^binding|increases^activity 20869355
4 143-08-8 NR1I3 Homo sapiens 1-nonanol binds to and results in increased activity of NR1I3 protein alternative form affects^binding|increases^activity 20869355
Serial No.Activity Name DetailsReferences (PubMed)Other details EPA (U.S)Clinical Trials (U.S. NIH)
1 143-08-8 Nonanol

Plant Variety and Essential oils

Serial No.Plant NameVariety NameEssential OilCompound Percentage
1 Dusky Geranium phaeum essential oil
2 Starflower Borago officinalis essential oil
3 Garden heliotrope Galium odoratum essential oil

Compound Image


2D Structure

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(External database - ChemAxon)