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Bicyclo [3.1.1] hept-2-ene,2,6-dimethyl
PHCD compound ID : 1784
Chemical Names :
Bicyclo [3.1.1] hept-2-ene,2,6-dimethyl
Molecular Formula : C9H14
Molecular Weight : 122.10955
More Details :
Names & Synonyms:
Smiles: CC1=CC[C@@H]2C[C@H]1[C@@H]2C
InChi : InChI=1S/C9H14/c1-6-3-4-8-5-9(6)7(8)2/h3,7-9H,4-5H2,1-2H3/t7-,8-,9-/m1/s1
InChi Key : InChIKey=FOGNKPRJPWRRCM-IWSPIJDZSA-N
PubChem ID :
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 0 Ionization potential : 9.108664
Hydrogen bond donor count : 0 Electric dipole moment : 0.285
XLogP : 3.571 VDW volume : 136.870944
Molecular weight : 122.10955 HOMO-LUMO gap : 10.404000
Herb list :
Refrences & Litretures:
  
202.      Journal:'Biotech Health Sci'      Year:'2015'      Volume:'2'      Page:'e26797'      DOI:'10.17795/bhs-26797'      Title:'Biological Properties of Vitex agnus-castus Essential Oil (Phytochemical Component, Antioxidant and Antifungal Activity)'
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