Skip Navigation Links
ScientificNameLabel
N-methyl-beta-phenethylamine
PHCD compound ID : 2548
Chemical Names :
N-methyl-beta-phenethylamine
Molecular Formula : C9H13N1
Molecular Weight : 135.104799
More Details :
Names & Synonyms: N-methyl-2-phenyl-ethanamine , N-methyl-2-phenylethanamine , methyl(phenethyl)amine
Smiles: CNCCc1ccccc1
InChi : InChI=1S/C9H13N/c1-10-8-7-9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3
InChi Key : InChIKey=SASNBVQSOZSTPD-UHFFFAOYSA-N
PubChem ID : 11503
Rotatable bond count : 3 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 9.089083
Hydrogen bond donor count : 1 Electric dipole moment : 1.696
XLogP : 1.496 VDW volume : 144.051246
Molecular weight : 135.104799 HOMO-LUMO gap : 9.359000
Herb list :
Refrences & Litretures:
  
294.      Journal:'International Journal of Herbal Medicine'      Year:'2014'      Volume:'2'      Page:'47'      DOI:''      Title:'Alhagi pseudalhagi: a review of its phyto-chemistry, pharmacology, folklore claims and Ayurvedic studies'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
Follow us