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ScientificNameLabel
Benzofuran-2-carboxaldehyde
PHCD compound ID : 5464
Chemical Names :
Benzofuran-2-carboxaldehyde
Molecular Formula : C9H6O2
Molecular Weight : 146.036779
More Details :
Names & Synonyms: benzofuran-2-carbaldehyde , 2-benzofurancarboxaldehyde , 1-benzofuran-2-carbaldehyde , coumarilaldehyde
Smiles: O=Cc1cc2c(o1)cccc2
InChi : InChI=1S/C9H6O2/c10-6-8-5-7-3-1-2-4-9(7)11-8/h1-6H
InChi Key : InChIKey=ADDZHRRCUWNSCS-UHFFFAOYSA-N
PubChem ID : 61341
Rotatable bond count : 1 Rule of five : 0
Hydrogen bond acceptor count : 2 Ionization potential : 9.528289
Hydrogen bond donor count : 0 Electric dipole moment : 2.883
XLogP : 1.022 VDW volume : 122.105563
Molecular weight : 146.036779 HOMO-LUMO gap : 8.450000
Herb list :
Refrences & Litretures:
  
911.      Journal:'Indian Journal of Pharmaceutical Education and Research'      Year:'2017'      Volume:'51'      Page:'S244'      DOI:'10.5530/ijper.51.3s.22'      Title:'Antimicrobial Activity and Chemical Composition Screening of Anacyclus pyrethrum Root'
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