Skip Navigation Links
ScientificNameLabel
Beta-vetivene
PHCD compound ID : 5296
Chemical Names :
Beta-vetivene
Molecular Formula : C15H24
Molecular Weight : 204.187801
More Details :
Names & Synonyms: 4-isopropyl-7-methylene-tricyclo[6.2.1.02,6]undecane , 7-methylene-4-propan-2-yltricyclo[6.2.1.02,6]undecane , 7-methylidene-4-propan-2-yltricyclo[6.2.1.02,6]undecane , 7-methylidene-4-propan-2-yltricyclo[6.2.1.02,6]undecane , 7-methylidene-4-propan-2-yl-tricyclo[6.2.1.02,6]undecane
Smiles: CC([C@@H]1C[C@@H]2[C@H](C1)[C@H]1CC[C@@H](C2=C)C1)C
InChi : InChI=1S/C15H24/c1-9(2)13-7-14-10(3)11-4-5-12(6-11)15(14)8-13/h9,11-15H,3-8H2,1-2H3/t11-,12+,13-,14+,15-/m1/s1
InChi Key : InChIKey=DFUVGLKCFAASAU-QKGCVVFFSA-N
PubChem ID : 529892
Rotatable bond count : 1 Rule of five : 1
Hydrogen bond acceptor count : 0 Ionization potential : 9.526665
Hydrogen bond donor count : 0 Electric dipole moment : 0.783
XLogP : 6.503 VDW volume : 228.290393
Molecular weight : 204.187801 HOMO-LUMO gap : 10.874000
Herb list :
Refrences & Litretures:
  
851.      Journal:'J. Essent. Oil Res'      Year:'1995'      Volume:'7'      Page:'147'      DOI:'10.1080/10412905.1995.9698489'      Title:'Chemical Composition of Eucalyptus globulus Oils from the Montenegro Coast and East Coast of Spain'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
Follow us