Skip Navigation Links
ScientificNameLabel
Phenol,4 propyl
PHCD compound ID : 1726
Chemical Names :
Phenol,4 propyl
Molecular Formula : C9H12O1
Molecular Weight : 136.088815
More Details :
Names & Synonyms: 4-propylphenol
Smiles: CCCc1ccc(cc1)O
InChi : InChI=1S/C9H12O/c1-2-3-8-4-6-9(10)7-5-8/h4-7,10H,2-3H2,1H3
InChi Key : InChIKey=KLSLBUSXWBJMEC-UHFFFAOYSA-N
PubChem ID : 12580
Rotatable bond count : 2 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 8.943355
Hydrogen bond donor count : 1 Electric dipole moment : 1.526
XLogP : 2.371 VDW volume : 141.844712
Molecular weight : 136.088815 HOMO-LUMO gap : 9.048000
Herb list :
Refrences & Litretures:
  
195.      Journal:'Int J Pharm Pharm Sci'      Year:'2014'      Volume:'6'      Page:'60'      DOI:''      Title:'GAS CHROMATOGRAPHY AND MASS SPECTROMETRY ANALYSIS OF BIOACTIVE CONSTITUENTS OF ADIANTUM CAPILLUS-VENERIS L'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
Follow us