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2,3,5,6-Tetramethylphenol
PHCD compound ID : 4535
Chemical Names :
2,3,5,6-Tetramethylphenol
Molecular Formula : C10H14O1
Molecular Weight : 150.104465
More Details :
Names & Synonyms: 2,3,5,6-tetramethylphenol
Smiles: Cc1cc(C)c(c(c1C)O)C
InChi : InChI=1S/C10H14O/c1-6-5-7(2)9(4)10(11)8(6)3/h5,11H,1-4H3
InChi Key : InChIKey=KLAQSPUVCDBEGF-UHFFFAOYSA-N
PubChem ID : 10694
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 8.690102
Hydrogen bond donor count : 1 Electric dipole moment : 1.291
XLogP : 2.092 VDW volume : 159.140697
Molecular weight : 150.104465 HOMO-LUMO gap : 9.154000
Herb list :
Refrences & Litretures:
  
677.      Journal:'J Sci Food Agric'      Year:'2013'      Volume:'93'      Page:'2707'      DOI:'10.1002/jsfa.6089'      Title:'Chemical composition and bioactivity of different oregano (Origanum vulgare) extracts and essential oil'
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