AG008U7J

1204400-58-7 | 6-Chloro-3-nitropyridine-2-carboxylic acid

AG008U7J

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CAS Number	1204400-58-7
Catalog Number	AG008U7J(AGN-PC-09LISQ)
Chemical Name	6-Chloro-3-nitropyridine-2-carboxylic acid
IUPAC Name	6-chloro-3-nitropyridine-2-carboxylic acid
InChI	InChI=1S/C6H3ClN2O4/c7-4-2-1-3(9(12)13)5(8-4)6(10)11/h1-2H,(H,10,11)
InChI Key	MHDMSQFCLBRNES-UHFFFAOYSA-N
MDL Number	MFCD00661262
Molecular Formula	C6H3ClN2O4
Molecular Weight	202.5520
SMILES	OC(=O)C1=NC(Cl)=CC=C1[N+]([O-])=O
Synonyms	6-Chloro-3-nitropicolinic acid, 1204400-58-7, 6-chloro-3-nitropyridine-2-carboxylic acid, CTK5I3455, DTXSID40680542, 3545AA, ANW-65756, MFCD00661262, ZINC67175737, AKOS016005467, PB14176, 2-CHLORO-5-NITRO-6-PICOLINICACID, AK-89008, AS-50409, 2-CHLORO-5-NITRO-6-PICOLINIC ACID, AJ-116902, DB-004010, TC-070178, CS-0050226, FT-0757756, ST24045282, C6H3ClN2O4, 6-Chloro-pyrido[3,2-d]pyrimidin-4(3H)-one,

Complexity	229
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	201.978g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	202.55g/mol
Monoisotopic Mass	201.978g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	96A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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