AromaDb: A Database of Plant's Aroma Molecules

Methyl Anthranilate Details

: IUPAC Name
methyl 2-aminobenzoate
:Chemical Class
Alcohol
:CAS Registry Number
134-20-3
:Description

:Fragrance Type
orange

Physical and Chemical properties

PUBCHEM ID8635
Molecular Weight (mg/mol)151.163
Molecular FormulaC8H9NO2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
IUPAC Namemethyl 2-aminobenzoate
Canonical SMILESCOC(=O)c1ccccc1N
PUBCHEM IUPAC INCHIKEYVAMXMNNIEUEQDV-UHFFFAOYSA-N
Solubility Level4
Vapour Pressure-1.966

Absorption and Metabolism information

XLOGP3 AA
CACTVS TPSA52.3
BBB Level3
Absorption Level0
EXT PPB#Prediction1
AlogP980.938
EXT CYP2D6#Prediction0

Toxicological Information

Mouse Female FDANon-Carcinogen
Mouse Male FDAMulti-Carcinogen
Rat Female FDASingle-Carcinogen
Rat Male FDAMulti-Carcinogen
Ames PredictionNon-Mutagen
Developmental / Reproductive ToxicityNon-Toxic
Rat Oral LD505.96804 g/kg_body_weight
Ocular IrritancyNone
Hepatotoxic#Prediction0
Effected Human GenesKYNU,HAAO,CAT,MAPK1,CCK,PLA2G2A,METAP2,AFMID,CTSB,GMPS,MMP2,BMP6,TTR,TGFB1,KNG1,CCKAR,DHODH,PGK1,TRPM2,KMO,DAO,AKR1C1,KLK1,CTSL,TGFB2

Ecological Information

Aerobic Biodegradability PredictionNon-Degradable

Hazard(s) Identification

Physical hazardsnot classified
Health hazards None
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)
1 134-20-3 Methyl Anthranilate

Plant Variety and Essential oils

Serial No.Plant NameVariety NameEssential OilCompound Percentage
1 Rajanigandha Polianthes tuberosa essential oil

Compound Image


2D Structure

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(External database - ChemAxon)