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Neo iso isopulegol
PHCD compound ID : 4112
Chemical Names :
Neo iso isopulegol
Molecular Formula : C10H18O1
Molecular Weight : 154.135765
More Details :
Names & Synonyms: 2-isopropenyl-5-methyl-cyclohexanol , 5-methyl-2-(1-methylethenyl)-1-cyclohexanol , 5-methyl-2-prop-1-en-2-ylcyclohexan-1-ol , 5-methyl-2-prop-1-en-2-yl-cyclohexan-1-ol
Smiles: C[C@@H]1CC[C@H]([C@@H](C1)O)C(=C)C
InChi : InChI=1S/C10H18O/c1-7(2)9-5-4-8(3)6-10(9)11/h8-11H,1,4-6H2,2-3H3/t8-,9+,10-/m1/s1
InChi Key : InChIKey=ZYTMANIQRDEHIO-KXUCPTDWSA-N
PubChem ID : 24585
Rotatable bond count : 1 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 9.829003
Hydrogen bond donor count : 1 Electric dipole moment : 1.703
XLogP : 2.395 VDW volume : 175.313614
Molecular weight : 154.135765 HOMO-LUMO gap : 10.815000
Herb list :
Refrences & Litretures:
  
572.      Journal:'Natural Product Research'      Year:'2015'      Volume:'29'      Page:'833'      DOI:'10.1080/14786419.2014.989394'      Title:'Fast determination of Ziziphora tenuior L. essential oil by inorganic–organic hybrid material based on ZnO nanoparticles anchored to a composite made from polythiophene and hexagonally ordered silica'
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