Skip Navigation Links
ScientificNameLabel
2-Nonyn-1-ol
PHCD compound ID : 2687
Chemical Names :
2-Nonyn-1-ol
Molecular Formula : C9H16O1
Molecular Weight : 140.120115
More Details :
Names & Synonyms: non-2-yn-1-ol , 2-nonyn-1-ol
Smiles: CCCCCCC#CCO
InChi : InChI=1S/C9H16O/c1-2-3-4-5-6-7-8-9-10/h10H,2-6,9H2,1H3
InChi Key : InChIKey=XERDOEKKHDALKJ-UHFFFAOYSA-N
PubChem ID : 80017
Rotatable bond count : 4 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 10.139728
Hydrogen bond donor count : 1 Electric dipole moment : 2.484
XLogP : 3.108 VDW volume : 167.73763
Molecular weight : 140.120115 HOMO-LUMO gap : 11.291000
Herb list :
Refrences & Litretures:
  
312.      Journal:'Talanta'      Year:'2010'      Volume:'81'      Page:'129'      DOI:'10.1016/j.talanta.2009.11.047'      Title:'Identi?cation of Portulaca oleracea L. from different sources using GC–MS and FT-IR spectroscopy'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
Follow us