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ScientificNameLabel
Piperonylamine
PHCD compound ID : 1220
Chemical Names :
Piperonylamine
Molecular Formula : C8H9N1O2
Molecular Weight : 151.063329
More Details :
Names & Synonyms: 1,3-benzodioxol-5-ylmethanamine , piperonylamine
Smiles: NCc1ccc2c(c1)OCO2
InChi : InChI=1S/C8H9NO2/c9-4-6-1-2-7-8(3-6)11-5-10-7/h1-3H,4-5,9H2
InChi Key : InChIKey=ZILSBZLQGRBMOR-UHFFFAOYSA-N
PubChem ID : 75799
Rotatable bond count : 1 Rule of five : 0
Hydrogen bond acceptor count : 3 Ionization potential : 8.919264
Hydrogen bond donor count : 1 Electric dipole moment : 2.043
XLogP : 0.3 VDW volume : 131.979256
Molecular weight : 151.063329 HOMO-LUMO gap : 8.748000
Herb list :
Refrences & Litretures:
  
125.      Journal:'Chemistry of Natural Compounds'      Year:'2008'      Volume:'44'      Page:'124'      DOI:''      Title:'STUDY OF THE ESSENTIAL OIL VARIATION OF Ferula gummosa SAMPLES FROM IRAN'
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