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ScientificNameLabel
4-(1-Methylethyliden) cyclohexanone
PHCD compound ID : 422
Chemical Names :
4-(1-Methylethyliden) cyclohexanone
Molecular Formula : C9H14O1
Molecular Weight : 138.104465
More Details :
Names & Synonyms: 4-isopropylidenecyclohexanone , 4-propan-2-ylidene-1-cyclohexanone , 4-propan-2-ylidenecyclohexan-1-one
Smiles: CC(=C1CCC(=O)CC1)C
InChi : InChI=1S/C9H14O/c1-7(2)8-3-5-9(10)6-4-8/h3-6H2,1-2H3
InChi Key : InChIKey=UJYNKPIXFNHCOE-UHFFFAOYSA-N
PubChem ID : 12691196
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 9.302902
Hydrogen bond donor count : 0 Electric dipole moment : 3.828
XLogP : 1.097 VDW volume : 155.381171
Molecular weight : 138.104465 HOMO-LUMO gap : 10.173000
Herb list :
Refrences & Litretures:
  
24.      Journal:'J. Iran. Chem. Soc'      Year:'2010'      Volume:'7'      Page:'216'      DOI:''      Title:'Chemical Composition and In vitro Antioxidant and Antidiabetic Activities of Eucalyptus Camaldulensis Dehnh. Essential Oil'
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