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ScientificNameLabel
cis-2-Methylcyclohexanol
PHCD compound ID : 5407
Chemical Names :
cis-2-Methylcyclohexanol
Molecular Formula : C7H14O1
Molecular Weight : 114.104465
More Details :
Names & Synonyms: (1S,2R)-2-methylcyclohexanol , (1S,2R)-2-methyl-1-cyclohexanol , (1S,2R)-2-methylcyclohexan-1-ol , (1S,2R)-2-methylcyclohexan-1-ol
Smiles: C[C@@H]1CCCC[C@@H]1O
InChi : InChI=1S/C7H14O/c1-6-4-2-3-5-7(6)8/h6-8H,2-5H2,1H3/t6-,7+/m1/s1
InChi Key : InChIKey=NDVWOBYBJYUSMF-RQJHMYQMSA-N
PubChem ID : 5325949
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 10.172231
Hydrogen bond donor count : 1 Electric dipole moment : 1.965
XLogP : 1.626 VDW volume : 126.062119
Molecular weight : 114.104465 HOMO-LUMO gap : 13.392000
Herb list :
Refrences & Litretures:
  
895.      Journal:'Pharmaceutical Biology'      Year:'2003'      Volume:'41'      Page:'399'      DOI:'10.1076/phbi.41.6.399.17826'      Title:'Volatile Compounds in Crude Salvadora persica Extracts'
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