AG00BCKP

253453-91-7 | 2-Chloro-1-methyl-1H-imidazole

AG00BCKP

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CAS Number	253453-91-7
Catalog Number	AG00BCKP(AGN-PC-0KKVCY)
Chemical Name	2-Chloro-1-methyl-1H-imidazole
IUPAC Name	2-chloro-1-methylimidazole
InChI	InChI=1S/C4H5ClN2/c1-7-3-2-6-4(7)5/h2-3H,1H3
InChI Key	VSCQFRRKWFQPOA-UHFFFAOYSA-N
MDL Number	MFCD02179531
Molecular Formula	C4H5ClN2
Molecular Weight	116.5489
SMILES	CN1C=CN=C1Cl
Synonyms	2-Chloro-1-methyl-1H-imidazole, 253453-91-7, 2-chloro-1-methylimidazole, MFCD02179531, 1H-IMIDAZOLE, 2-CHLORO-1-METHYL-, PubChem7596, AC1MCMSK, ACMC-209gjb, SCHEMBL1701532, CTK4F5522, 1-Methyl-2-chloro-1H-imidazole, DTXSID50378382, VSCQFRRKWFQPOA-UHFFFAOYSA-N, 1H-Imidazole,2-chloro-1-methyl-, ACN-P001168, ACT03765, KS-00000JP6, ZINC2577856, ANW-25701, BBL102976, STL556785, AKOS005255505, AB11324, CC-1378, PS-3321, RP00632, RTR-011587, VI10110, AC-28871, AJ-42684, AK-79282, CJ-10139, AB0038017, DB-046677, TL8007081, TR-011587, 2-chloro-1-methyl-1H-imidazole, AldrichCPR, FT-0644131, ST24022116, Y5361, 453C917, Q-200535, W-206949, C4H5ClN2, 5-Bromo-5-nitro-1,3-dioxane, ZINC02577856, CID2773332, 1H-Imidazole, 2-chloro-1-methyl- (9CI), C-1400, 2-chloro-1-methyl-1H-imidazole, 95% - 1G 1g,

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	0
Isotope Atom Count	0
Molecular Weight	116.548g/mol
Monoisotopic Mass	116.014g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	17.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.1

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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