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ScientificNameLabel
Methyl anthranilate
PHCD compound ID : 2378
Chemical Names :
Methyl anthranilate
Molecular Formula : C8H9N1O2
Molecular Weight : 151.063329
More Details :
Names & Synonyms: methyl 2-aminobenzoate , 2-aminobenzoic acid methyl ester , methyl 2-azanylbenzoate
Smiles: COC(=O)c1ccccc1N
InChi : InChI=1S/C8H9NO2/c1-11-8(10)6-4-2-3-5-7(6)9/h2-5H,9H2,1H3
InChi Key : InChIKey=VAMXMNNIEUEQDV-UHFFFAOYSA-N
PubChem ID : 8635
Rotatable bond count : 2 Rule of five : 0
Hydrogen bond acceptor count : 3 Ionization potential : 8.647195
Hydrogen bond donor count : 1 Electric dipole moment : 1.016
XLogP : 0.818 VDW volume : 141.699256
Molecular weight : 151.063329 HOMO-LUMO gap : 8.275000
Herb list :
Refrences & Litretures:
  
263.      Journal:'Z Lebensm Unters Forsch A'      Year:'1997'      Volume:'205'      Page:'218'      DOI:''      Title:'Analysis of strawberry flavour - discrimination of aroma types by quantification of volatile compounds'
829.      Journal:'Czech Journal of Food Sciences'      Year:'2019'      Volume:'37'      Page:'81'      DOI:'10.17221/202/2017-CJFS'      Title:'Chemical composition, antimicrobial and insecticidal activities of the tunisian Citrus aurantium essential oils'
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