Skip Navigation Links
ScientificNameLabel
2-Cyclohexene-1-methanol
PHCD compound ID : 1084
Chemical Names :
2-Cyclohexene-1-methanol
Molecular Formula : C7H12O1
Molecular Weight : 112.088815
More Details :
Names & Synonyms: cyclohex-2-en-1-ylmethanol , 1-cyclohex-2-enylmethanol
Smiles: OC[C@H]1CCCC=C1
InChi : InChI=1S/C7H12O/c8-6-7-4-2-1-3-5-7/h2,4,7-8H,1,3,5-6H2/t7-/m1/s1
InChi Key : InChIKey=TZTRNALMVOGNSM-SSDOTTSWSA-N
PubChem ID : 11083859
Rotatable bond count : 1 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 9.593674
Hydrogen bond donor count : 1 Electric dipole moment : 2.245
XLogP : 1.426 VDW volume : 123.42566
Molecular weight : 112.088815 HOMO-LUMO gap : 10.831000
Herb list :
Refrences & Litretures:
  
111.      Journal:'Pharmaceutical sciences'      Year:'2013'      Volume:'18'      Page:'187'      DOI:''      Title:'Chemical Composition and Antinociceptive Effect of the Essential Oil of Dracocephalum moldavica L'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
Follow us