AG00EDAE

62366-58-9 | (1-Methyl-1H-imidazol-2-yl)-oxo-acetic acid ethyl ester

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CAS Number	62366-58-9
Catalog Number	AG00EDAE(AGN-PC-0L6ELZ)
Chemical Name	(1-Methyl-1H-imidazol-2-yl)-oxo-acetic acid ethyl ester
IUPAC Name	ethyl 2-(1-methylimidazol-2-yl)-2-oxoacetate
InChI	InChI=1S/C8H10N2O3/c1-3-13-8(12)6(11)7-9-4-5-10(7)2/h4-5H,3H2,1-2H3
InChI Key	UFHSIGMMKGIGDH-UHFFFAOYSA-N
MDL Number	MFCD02703593
Molecular Formula	C8H10N2O3
Molecular Weight	182.1766
SMILES	O=C(OCC)C(C1=NC=CN1C)=O
Synonyms	62366-58-9, ethyl 2-(1-methyl-1H-imidazol-2-yl)-2-oxoacetate, (1-Methyl-1H-imidazol-2-yl)-oxo-acetic acid ethyl ester, ethyl 2-(1-methylimidazol-2-yl)-2-oxoacetate, BAS 11438274, AC1N4TIW, SCHEMBL368253, AC1Q31X7, CTK5B4963, DTXSID90400095, ANW-60538, SBB010682, ZINC12412195, AKOS000303296, MCULE-8194631264, RP09163, AJ-62222, ST078203, DB-073107, TR-056161, BB 0257554, FT-0734057, Z3146, EN300-52431, ethyl (1-methyl-1H-imidazol-2-yl)(oxo)acetate, J-520579, Z56783704, alpha-Oxo-1-methyl-1H-imidazole-2-acetic acid ethyl ester, Ethyl 2-(1-methylimidazol-2-yl)-2-oxoacetate, AldrichCPR, C8H10N2O3, CID4160985, C-1428, Ethyl2-(1-methyl-1H-imidazol-2-yl)-2-oxoacetate, (1-Methyl-1H-imidazol-2-yl)-oxo-acetic acid ethyl ester, 97% - 1G 1g,

Complexity	217
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	182.069g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	182.179g/mol
Monoisotopic Mass	182.069g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	61.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.4

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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