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ScientificNameLabel
Exo-2-hydroxycineole
PHCD compound ID : 858
Chemical Names :
Exo-2-hydroxycineole
Molecular Formula : C10H18O2
Molecular Weight : 170.13068
More Details :
Names & Synonyms: 2,2,4-trimethyl-3-oxabicyclo[2.2.2]octan-5-ol
Smiles: O[C@@H]1C[C@H]2CC[C@]1(C)OC2(C)C
InChi : InChI=1S/C10H18O2/c1-9(2)7-4-5-10(3,12-9)8(11)6-7/h7-8,11H,4-6H2,1-3H3/t7-,8-,10+/m1/s1
InChi Key : InChIKey=YVCUGZBVCHODNB-MRTMQBJTSA-N
PubChem ID : 529885
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 2 Ionization potential : 9.326745
Hydrogen bond donor count : 1 Electric dipole moment : 2.931
XLogP : 1.565 VDW volume : 174.383841
Molecular weight : 170.13068 HOMO-LUMO gap : 11.992000
Herb list :
Refrences & Litretures:
  
71.      Journal:'Food Chemistry'      Year:'2005'      Volume:'91'      Page:'131'      DOI:'10.1016/j.foodchem.2004.05.056'      Title:'Identi?cation of volatile components in basil (Ocimum basilicum L.) and thyme leaves (Thymus vulgaris L.) and their antioxidant properties'
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