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1,3,5-Trimethyl benzene
ScientificNameLabel
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 :
Fever few - Tanacetum parthenium - بابونه گاوی، مخلصه
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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