Benzene.1.2.4-trimethyl-5-(1-methylethenyl)-

ScientificNameLabel

Benzene.1.2.4-trimethyl-5-(1-methylethenyl)-
PHCD compound ID :	3720
Chemical Names :	Benzene.1.2.4-trimethyl-5-(1-methylethenyl)-
Molecular Formula :	C12H16
Molecular Weight :	160.125201

More Details :

Names & Synonyms:	1-isopropenyl-2,4,5-trimethyl-benzene , 1,2,4-trimethyl-5-(1-methylethenyl)benzene , 1,2,4-trimethyl-5-prop-1-en-2-ylbenzene , 1,2,4-trimethyl-5-prop-1-en-2-yl-benzene
Smiles:	Cc1cc(C(=C)C)c(cc1C)C
InChi :	InChI=1S/C12H16/c1-8(2)12-7-10(4)9(3)6-11(12)5/h6-7H,1H2,2-5H3
InChi Key :	InChIKey=IFKGNSBJIQOCSH-UHFFFAOYSA-N
PubChem ID :	94566

Rotatable bond count :	1	Rule of five :	0
Hydrogen bond acceptor count :	0	Ionization potential :	8.873377
Hydrogen bond donor count :	0	Electric dipole moment :	0.979
XLogP :	4.505	VDW volume :	182.305981
Molecular weight :	160.125201	HOMO-LUMO gap :	9.334000

Herb list :

Licorice, Liquorice - Glycyrrhiza glabra - شیرین بیان

Refrences & Litretures:


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'

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