AromaDb: A Database of Plant's Aroma Molecules

(E)-2-Decenal Details

: IUPAC Name
(E)-dec-2-enal
:Chemical Class
Aldehyde
:CAS Registry Number
3913-81-3
:Description

2-Decenal is found in animal foods. 2-Decenal is a constituent of essential oil of coriander. Also present in French fries, tomato, wheat bread, cooked meats, roasted pecans, roasted filbert and rice. 2-Decenal is a flavouring agent. 2-decenal belongs to the family of Medium-chain Aldehydes. These are An aldehyde with a chain length containing between 6 and 12 carbon atoms.

:Fragrance Type
orange

Physical and Chemical properties

PUBCHEM ID5283345
Molecular Weight (mg/mol)154.249
Molecular FormulaC10H18O
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count7
IUPAC Name(E)-dec-2-enal
Canonical SMILESCCCCCCC/C=C/C=O
PUBCHEM IUPAC INCHIKEYMMFCJPPRCYDLLZ-CMDGGOBGSA-N
Solubility Level3
Vapour Pressure-0.807

Absorption and Metabolism information

XLOGP3 AA3.7
CACTVS TPSA17.1
BBB Level0
Absorption Level0
EXT PPB#Prediction1
AlogP983.654
EXT CYP2D6#Prediction0

Toxicological Information

Mouse Female FDANon-Carcinogen
Mouse Male FDAMulti-Carcinogen
Rat Female FDASingle-Carcinogen
Rat Male FDANon-Carcinogen
Ames PredictionNon-Mutagen
Developmental / Reproductive ToxicityNon-Toxic
Rat Oral LD503.20854 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
1 3913-81-3
2 3913-81-3
3 3913-81-3
4 3913-81-3
5 3913-81-3
6 3913-81-3
Serial No.Activity Name DetailsReferences (PubMed)Other details EPA (U.S)Clinical Trials (U.S. NIH)
1Nematicidal1 3913-81-3 (E)-2-Decenal

Plant Variety and Essential oils

Serial No.Plant NameVariety NameEssential OilCompound Percentage
1 Snowbell styrax officinalis essential oil

Compound Image


2D Structure

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(External database - ChemAxon)