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1,3,5-Trimethyl benzene
PHCD compound ID : 743
Chemical Names :
1,3,5-Trimethyl benzene
Molecular Formula : C9H12
Molecular Weight : 120.0939
More Details :
Names & Synonyms: mesitylene , 1,3,5-trimethylbenzene
Smiles: Cc1cc(C)cc(c1)C
InChi : InChI=1S/C9H12/c1-7-4-8(2)6-9(3)5-7/h4-6H,1-3H3
InChi Key : InChIKey=AUHZEENZYGFFBQ-UHFFFAOYSA-N
PubChem ID : 7947
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 0 Ionization potential : 9.184810
Hydrogen bond donor count : 0 Electric dipole moment : 0.205
XLogP : 3.258 VDW volume : 133.054486
Molecular weight : 120.0939 HOMO-LUMO gap : 9.732000
Herb list :
Refrences & Litretures:
  
52.      Journal:'Journal of Oleo Science'      Year:'2010'      Volume:'59'      Page:'177'      DOI:''      Title:'Antibacterial Activity and the Variation of Tanacetum parthenium (L.) Schultz Bip. Essential Oils from Turkey'
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