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ScientificNameLabel
trans-2-Hydroxypinocamphone
PHCD compound ID : 3056
Chemical Names :
trans-2-Hydroxypinocamphone
Molecular Formula : C10H16O2
Molecular Weight : 168.11503
More Details :
Names & Synonyms: (2R)-2-hydroxy-2,6,6-trimethyl-norpinan-3-one , (4R)-4-hydroxy-4,6,6-trimethyl-3-bicyclo[3.1.1]heptanone , (4R)-4-hydroxy-4,6,6-trimethylbicyclo[3.1.1]heptan-3-one , (4R)-4,6,6-trimethyl-4-oxidanyl-bicyclo[3.1.1]heptan-3-one
Smiles: O=C1C[C@@H]2C[C@H]([C@@]1(C)O)C2(C)C
InChi : InChI=1S/C10H16O2/c1-9(2)6-4-7(9)10(3,12)8(11)5-6/h6-7,12H,4-5H2,1-3H3/t6-,7-,10+/m0/s1
InChi Key : InChIKey=VZRRCQOUNSHSGB-MHYGZLNHSA-N
PubChem ID : 12760079
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 2 Ionization potential : 9.700434
Hydrogen bond donor count : 1 Electric dipole moment : 2.500
XLogP : 1.494 VDW volume : 171.747382
Molecular weight : 168.11503 HOMO-LUMO gap : 10.369000
Herb list :
Refrences & Litretures:
  
395.      Journal:'Journal of Essential Oil Bearing Plants'      Year:'2009'      Volume:'12'      Page:'111'      DOI:'10.1080/0972060X.2009.10643700'      Title:'Chemical Composition and Antimicrobial Activity of Essential Oil of Hyssopus angustifolius M.B'
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