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ScientificNameLabel
Isopiperitenol
PHCD compound ID : 1435
Chemical Names :
Isopiperitenol
Molecular Formula : C10H16O1
Molecular Weight : 152.120115
More Details :
Names & Synonyms: 6-isopropenyl-3-methyl-cyclohex-2-en-1-ol , 3-methyl-6-(1-methylethenyl)-1-cyclohex-2-enol , 3-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-ol , 3-methyl-6-prop-1-en-2-yl-cyclohex-2-en-1-ol
Smiles: CC1=C[C@H]([C@@H](CC1)C(=C)C)O
InChi : InChI=1S/C10H16O/c1-7(2)9-5-4-8(3)6-10(9)11/h6,9-11H,1,4-5H2,2-3H3/t9-,10+/m0/s1
InChi Key : InChIKey=OLAKPNFIICOONC-VHSXEESVSA-N
PubChem ID : 527822
Rotatable bond count : 1 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 9.491544
Hydrogen bond donor count : 1 Electric dipole moment : 2.909
XLogP : 1.699 VDW volume : 172.677156
Molecular weight : 152.120115 HOMO-LUMO gap : 10.404000
Herb list :
Refrences & Litretures:
  
154.      Journal:'Flavour Fragr. J'      Year:'1997'      Volume:'12'      Page:'71'      DOI:''      Title:'Constituents of the Essential Oil of Achillea eriophora DC'
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