AG005YV1

97602-72-7 | Methyl 2-methyl-1h-imidazole-4-carboxylate

AG005YV1

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CAS Number	97602-72-7
Catalog Number	AG005YV1(AGN-PC-0OOOHR)
Chemical Name	Methyl 2-methyl-1h-imidazole-4-carboxylate
IUPAC Name	methyl 2-methyl-1H-imidazole-5-carboxylate
InChI	InChI=1S/C6H8N2O2/c1-4-7-3-5(8-4)6(9)10-2/h3H,1-2H3,(H,7,8)
InChI Key	WPPRAPIAKXDXIP-UHFFFAOYSA-N
MDL Number	MFCD06203995
Molecular Formula	C6H8N2O2
Molecular Weight	140.1399
SMILES	O=C(C1=CN=C(C)N1)OC
Synonyms	97602-72-7, methyl 2-methyl-1H-imidazole-4-carboxylate, methyl 2-methyl-1H-imidazole-5-carboxylate, 2-METHYL-1H-IMIDAZOLE-4-CARBOXYLIC ACID METHYL ESTER, SCHEMBL692975, CTK5H9421, DTXSID90540622, WPPRAPIAKXDXIP-UHFFFAOYSA-N, MFCD06203995, ZINC39087239, AKOS011535671, methyl 2-methylimidazole-4-carboxylate, MCULE-3691310870, NE55823, AK311834, BS-13314, EN300-85495, Z1350606456, 1H-Imidazole-4-carboxylic acid, 2-methyl-, methyl ester, 1H-Imidazole-4-carboxylicacid,2-methyl-,methylester, 1H-Imidazole-4-carboxylic acid, 2-methyl-, methyl ester (9CI),

Complexity	138
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	140.059g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	140.142g/mol
Monoisotopic Mass	140.059g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	55A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.6

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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