AG004L0Q

86604-94-6 | 4-chloro-5-methyl-1H-imidazole

AG004L0Q

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CAS Number	86604-94-6
Catalog Number	AG004L0Q(AGN-PC-0JOU4X)
Chemical Name	4-chloro-5-methyl-1H-imidazole
EC Number	289-259-0
IUPAC Name	4-chloro-5-methyl-1H-imidazole
InChI	InChI=1S/C4H5ClN2/c1-3-4(5)7-2-6-3/h2H,1H3,(H,6,7)
InChI Key	QJHGJSHNFXKDQH-UHFFFAOYSA-N
MDL Number	MFCD19226195
Molecular Formula	C4H5ClN2
Molecular Weight	116.5489
SMILES	ClC=1N=CNC1C
Synonyms	4-chloro-5-methyl-1H-imidazole, 4-Chloro-5-methyl-1H-imidazole, 5-chloro-4-methyl-1H-imidazole, 86604-94-6, EINECS 289-259-0, AC1L7MXJ, 4-methyl-5-chloroimidazole, SCHEMBL3012280, CTK3F0299, DTXSID20235695, QJHGJSHNFXKDQH-UHFFFAOYSA-N, KS-000005JP, ZINC5503829, MFCD19226195, AKOS006376106, AM87271, FCH1111381, AS-53513, CS-0050518, FT-0759631, C4-H5-Cl-N2, 1H-Imidazole, 5-chloro-4-methyl-, CID313196, N/A,

Complexity	66.7
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	116.014g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	116.548g/mol
Monoisotopic Mass	116.014g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	28.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number