AG006XPX

22509-02-0 | 2-Isopropyl-1-methyl-1H-imidazole

AG006XPX

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CAS Number	22509-02-0
Catalog Number	AG006XPX(AGN-PC-00KR7V)
Chemical Name	2-Isopropyl-1-methyl-1H-imidazole
IUPAC Name	1-methyl-2-propan-2-ylimidazole
InChI	InChI=1S/C7H12N2/c1-6(2)7-8-4-5-9(7)3/h4-6H,1-3H3
InChI Key	IOILKZYWNMYWJY-UHFFFAOYSA-N
MDL Number	MFCD11053674
Molecular Formula	C7H12N2
Molecular Weight	124.1836
SMILES	CC(C1N(C)C=CN=1)C
Synonyms	2-Isopropyl-1-methyl-1H-imidazole, 22509-02-0, 1-METHYL-2-ISOPROPYL-IMIDAZOLE, 2-Isopropyl-1-methylimidazole, 1-methyl-2-(propan-2-yl)-1H-imidazole, 1H-Imidazole, 1-methyl-2-(1-methylethyl)-, SCHEMBL48851, CTK4E9618, DTXSID60517366, 1-Methyl-2-isopropyl-1H-imidazole, 1354AB, MFCD11053674, ZINC39387124, AKOS013464908, AS-37970, 1H-Imidazole,1-methyl-2-(1-methylethyl)-, J-014743, Z1532754050, C7H12N2,

Complexity	90.9
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	124.1g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	124.187g/mol
Monoisotopic Mass	124.1g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	17.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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