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ScientificNameLabel
N-Phenyl-2-naphthalenamine
PHCD compound ID : 2421
Chemical Names :
N-Phenyl-2-naphthalenamine
Molecular Formula : C16H13N1
Molecular Weight : 219.104799
More Details :
Names & Synonyms: N-phenylnaphthalen-2-amine , N-phenyl-2-naphthalenamine , 2-naphthyl(phenyl)amine
Smiles: c1ccc(cc1)Nc1ccc2c(c1)cccc2
InChi : InChI=1S/C16H13N/c1-2-8-15(9-3-1)17-16-11-10-13-6-4-5-7-14(13)12-16/h1-12,17H
InChi Key : InChIKey=KEQFTVQCIQJIQW-UHFFFAOYSA-N
PubChem ID : 8679
Rotatable bond count : 2 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 8.105183
Hydrogen bond donor count : 1 Electric dipole moment : 1.063
XLogP : 3.036 VDW volume : 205.427927
Molecular weight : 219.104799 HOMO-LUMO gap : 7.550000
Herb list :
Refrences & Litretures:
  
269.      Journal:'Zeitschrift fur Naturforschung C'      Year:'1998'      Volume:'53'      Page:'811'      DOI:''      Title:'Chemical Constituents from Shoots of Hordeum vulgare Infested by the Aphid Schizaphis graminum'
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