AG00E25S

52062-26-7 | 4-Methoxypyridine-2,6-dicarboxylic acid

AG00E25S

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CAS Number	52062-26-7
Catalog Number	AG00E25S(AGN-PC-0N59OQ)
Chemical Name	4-Methoxypyridine-2,6-dicarboxylic acid
IUPAC Name	4-methoxypyridine-2,6-dicarboxylic acid
InChI	InChI=1S/C8H7NO5/c1-14-4-2-5(7(10)11)9-6(3-4)8(12)13/h2-3H,1H3,(H,10,11)(H,12,13)
InChI Key	INGKNNWONGEVCL-UHFFFAOYSA-N
MDL Number	MFCD11036211
Molecular Formula	C8H7NO5
Molecular Weight	197.1449
SMILES	O=C(C1=NC(C(O)=O)=CC(OC)=C1)O
Synonyms	4-methoxypyridine-2,6-dicarboxylic Acid, 52062-26-7, J-400618, PYCH11, SCHEMBL746177, CTK4J5348, DTXSID10440716, FCH886278, MFCD11036211, ZINC35653845, AKOS006307785, 4-methoxy-2,6-pyridinedicarboxylic acid, AK578363, DS-19662, CID10488153,

Complexity	220
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	197.032g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	197.146g/mol
Monoisotopic Mass	197.032g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	96.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.5

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number