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ScientificNameLabel
Pinanediol
PHCD compound ID : 5287
Chemical Names :
Pinanediol
Molecular Formula : C10H18O2
Molecular Weight : 170.13068
More Details :
Names & Synonyms: (1R,2R,3S,5R)-2,6,6-trimethylnorpinane-2,3-diol , (1R,2R,3S,5R)-2,6,6-trimethylbicyclo[3.1.1]heptane-2,3-diol , (1R,2R,3S,5R)-2,6,6-trimethylbicyclo[3.1.1]heptane-2,3-diol
Smiles: O[C@H]1C[C@H]2C[C@@H]([C@@]1(C)O)C2(C)C
InChi : InChI=1S/C10H18O2/c1-9(2)6-4-7(9)10(3,12)8(11)5-6/h6-8,11-12H,4-5H2,1-3H3/t6-,7-,8+,10-/m1/s1
InChi Key : InChIKey=MOILFCKRQFQVFS-BDNRQGISSA-N
PubChem ID : 6553875
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 2 Ionization potential : 10.040812
Hydrogen bond donor count : 2 Electric dipole moment : 2.312
XLogP : 1.944 VDW volume : 174.383841
Molecular weight : 170.13068 HOMO-LUMO gap : 12.457000
Herb list :
Refrences & Litretures:
  
847.      Journal:'ORIENTAL JOURNAL OF CHEMISTRY'      Year:'2016'      Volume:'32'      Page:'331'      DOI:'10.13005/ojc/320137'      Title:'A Comparative Study of the Chemical Composition of the Essential oil from Eucalyptus globulus Growing in Dehradun (india) and Around the World'
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