AG002BP9

19872-91-4 | 2,6-Pyridinedicarboxylic acid, 4-hydroxy-, 2,6-dimethyl ester

AG002BP9

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CAS Number	19872-91-4
Catalog Number	AG002BP9(AGN-PC-0O6ULL)
Chemical Name	2,6-Pyridinedicarboxylic acid, 4-hydroxy-, 2,6-dimethyl ester
IUPAC Name	dimethyl 4-oxo-1H-pyridine-2,6-dicarboxylate
InChI	InChI=1S/C9H9NO5/c1-14-8(12)6-3-5(11)4-7(10-6)9(13)15-2/h3-4H,1-2H3,(H,10,11)
InChI Key	FERASHUCDLDGHK-UHFFFAOYSA-N
MDL Number	MFCD00185834
Molecular Formula	C9H9NO5
Molecular Weight	211.1715
SMILES	COC(=O)C1=CC(O)=CC(=N1)C(=O)OC
Synonyms	19872-91-4, dimethyl 4-hydroxypyridine-2,6-dicarboxylate, dimethyl 4-oxo-1,4-dihydropyridine-2,6-dicarboxylate, 2,6-dimethyl 4-hydroxypyridine-2,6-dicarboxylate, 20443-03-2, dimethyl 4-hydroxy-2,6-pyridinedicarboxylate, dimethyl 4-oxo-1H-pyridine-2,6-dicarboxylate, 4-Hydroxy-2,6-pyridinedicarboxylic acid dimethyl ester, 2,6-Pyridinedicarboxylic acid, 4-hydroxy-, 2,6-dimethyl ester, AC1LC18Q, AC1Q433B, CHEMBL271858, SCHEMBL1999533, SCHEMBL15865616, DTXSID60343829, FERASHUCDLDGHK-UHFFFAOYSA-N, KS-000017WU, ZX-AN016725, BBL019184, MFCD00824779, STL140904, ZINC91689888, AKOS000276705, AKOS015917003, MCULE-8061184506, AX8299295, DB-065977, Dimethyl4-Hydroxy-2,6-pyridinedicarboxylate, 4CH-000528, CS-0089805, D4925, FT-0655119, T7510, L-2086, A814023, J-400911, S02-0046, dimethyl-1,4-dihydro-4-oxopyridine-2,6-dicarboxylate, 4-hydroxy-pyridine-2,6-dicarboxylic acid dimethyl ester, 4-oxo-1H-pyridine-2,6-dicarboxylic acid dimethyl ester, dimethyl 4-oxidanylidene-1H-pyridine-2,6-dicarboxylate, Dimethyl 4-oxo-1,4-dihydro-2,6-pyridinedicarboxylate #, 2,6-Pyridinedicarboxylic acid, 4-hydroxy-, dimethyl ester, 1,4-Dihydro-4-oxopyridine-2,6-dicarboxylic acid dimethyl ester, Pyridine-2,6-dicarboxylic acid, 1,4-dihydro-4-oxo-, dimethyl ester, 2,6-dimethylpyridinedicarboxylate, CID592568, ZINC00968518, Dimethyl4-hydroxypyridine-2,6-dicarboxylate,

Complexity	346
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	211.048g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	211.173g/mol
Monoisotopic Mass	211.048g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	81.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

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