Skip Navigation Links
ScientificNameLabel
1-Methyl-4-(5-methyl-1-methylene-4-hexenyl-cyclohexene
PHCD compound ID : 3100
Chemical Names :
1-Methyl-4-(5-methyl-1-methylene-4-hexenyl-cyclohexene
Molecular Formula : C15H24
Molecular Weight : 204.187801
More Details :
Names & Synonyms: (4R)-1-methyl-4-(5-methyl-1-methylene-hex-4-enyl)cyclohexene , (4R)-1-methyl-4-(6-methylhepta-1,5-dien-2-yl)cyclohexene
Smiles: CC(=CCCC(=C)[C@@H]1CCC(=CC1)C)C
InChi : InChI=1S/C15H24/c1-12(2)6-5-7-14(4)15-10-8-13(3)9-11-15/h6,8,15H,4-5,7,9-11H2,1-3H3/t15-/m0/s1
InChi Key : InChIKey=XZRVRYFILCSYSP-HNNXBMFYSA-N
PubChem ID : 68128
Rotatable bond count : 4 Rule of five : 1
Hydrogen bond acceptor count : 0 Ionization potential : 9.183674
Hydrogen bond donor count : 0 Electric dipole moment : 1.400
XLogP : 5.551 VDW volume : 247.730393
Molecular weight : 204.187801 HOMO-LUMO gap : 10.322000
Herb list :
Refrences & Litretures:
  
407.      Journal:'Journal of Chromatography A'      Year:'2006'      Volume:'1102'      Page:'11'      DOI:'10.1016/j.chroma.2005.10.032'      Title:'Improved solvent-free microwave extraction of essential oil from dried Cuminum cyminum L. and Zanthoxylum bungeanum Maxim'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
Follow us