AromaDb: A Database of Plant's Aroma Molecules

Cassia aldehyde Details

: IUPAC Name
Cinnamaldehyde
:Chemical Class
:CAS Registry Number
14371-10-9
:Description

:Fragrance Type
cinnamon

Physical and Chemical properties

PUBCHEM ID637511
Molecular Weight (mg/mol)132.163
Molecular FormulaC9H8O
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
IUPAC NameCinnamaldehyde
Canonical SMILESO=C/C=C/c1ccccc1
PUBCHEM IUPAC INCHIKEYKJPRLNWUNMBNBZ-QPJJXVBHSA-N
Solubility Level3
Vapour Pressure

Absorption and Metabolism information

XLOGP3 AANA
CACTVS TPSA17.07
BBB Level1
Absorption Level0
EXT PPB#Prediction1
AlogP981.949
EXT CYP2D6#Prediction0

Toxicological Information

Mouse Female FDAMulti-Carcinogen
Mouse Male FDAMulti-Carcinogen
Rat Female FDANon-Carcinogen
Rat Male FDAMulti-Carcinogen
Ames PredictionNon-Mutagen
Developmental / Reproductive ToxicityToxic
Rat Oral LD501.13256
Ocular IrritancyMild
Hepatotoxic#Prediction0
Effected Human GenesNA

Ecological Information

Aerobic Biodegradability PredictionNon-Degradable

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 14371-10-9
2 14371-10-9
3 14371-10-9
4 14371-10-9
Serial No.Activity Name DetailsReferences (PubMed)Other details EPA (U.S)Clinical Trials (U.S. NIH)
1 14371-10-9 Cassia aldehyde

Compound Image


2D Structure

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