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ScientificNameLabel
Trimethylbenzene
PHCD compound ID : 744
Chemical Names :
1,2,3-Trimethyl benzene , 1,2,3-trimethylbenzene , 1.2.3-Trimethylbenzene , Trimethylbenzene
Molecular Formula : C9H12
Molecular Weight : 120.0939
More Details :
Names & Synonyms: 1,2,3-trimethylbenzene , hemimellitene
Smiles: Cc1c(C)cccc1C
InChi : InChI=1S/C9H12/c1-7-5-4-6-8(2)9(7)3/h4-6H,1-3H3
InChi Key : InChIKey=FYGHSUNMUKGBRK-UHFFFAOYSA-N
PubChem ID : 10686
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 0 Ionization potential : 9.136119
Hydrogen bond donor count : 0 Electric dipole moment : 1.215
XLogP : 3.258 VDW volume : 133.054486
Molecular weight : 120.0939 HOMO-LUMO gap : 9.652000
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'
339.      Journal:'J. Agric. Food Chem'      Year:'1978'      Volume:'26'      Page:'1290'      DOI:'10.1021/jf60220a012'      Title:'Volatile components of corn silk (Zea mays L.): possible Heliothis zea (Boddie) attractants'
513.      Journal:'J. of Supercritical Fluids'      Year:'2014'      Volume:'95'      Page:'373'      DOI:'10.1016/j.sup?u.2014.08.009'      Title:'Bio-oil production from Glycyrrhiza glabra through supercritical ?uid extraction'
544.      Journal:'International Journal of Food Properties'      Year:'2013'      Volume:'16'      Page:'18'      DOI:'10.1080/10942912.2010.513616'      Title:'Pakistani Bell Pepper (Capsicum annum L.): Chemical Compositions and its Antioxidant Activity'
867.      Journal:'Parasitol Res'      Year:'2013'      Volume:'112'      Page:'1197'      DOI:'10.1007/s00436-012-3251-9'      Title:'Essential oil composition and larvicidal activity of Toddalia asiatica roots against the mosquito Aedes albopictus (Diptera: Culicidae)'
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