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ScientificNameLabel
1-Methylethylideneyl-cyclohexane
PHCD compound ID : 3096
Chemical Names :
1-Methylethylideneyl-cyclohexane , Cyclohexane,1-methylethylideneyl
Molecular Formula : C9H16
Molecular Weight : 124.125201
More Details :
Names & Synonyms: isopropylidenecyclohexane , propan-2-ylidenecyclohexane
Smiles: CC(=C1CCCCC1)C
InChi : InChI=1S/C9H16/c1-8(2)9-6-4-3-5-7-9/h3-7H2,1-2H3
InChi Key : InChIKey=CUYJYVAWBJXBIC-UHFFFAOYSA-N
PubChem ID : 138578
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 0 Ionization potential : 8.813321
Hydrogen bond donor count : 0 Electric dipole moment : 0.049
XLogP : 3.591 VDW volume : 149.227403
Molecular weight : 124.125201 HOMO-LUMO gap : 10.312000
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'
410.      Journal:'Food Chemistry'      Year:'2009'      Volume:'115'      Page:'1114'      DOI:'10.1016/j.foodchem.2008.12.091'      Title:'Extraction of Cuminum cyminum essential oil by combination technology of organic solvent with low boiling point and steam distillation'
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