AG003JTW

59290-85-6 | 3-Nitropyridine-2-carboxylic acid

AG003JTW

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CAS Number	59290-85-6
Catalog Number	AG003JTW(AGN-PC-01V73L)
Chemical Name	3-Nitropyridine-2-carboxylic acid
IUPAC Name	3-nitropyridine-2-carboxylic acid
InChI	InChI=1S/C6H4N2O4/c9-6(10)5-4(8(11)12)2-1-3-7-5/h1-3H,(H,9,10)
InChI Key	ZUUJWCKWJJGJOE-UHFFFAOYSA-N
MDL Number	MFCD06658500
Molecular Formula	C6H4N2O4
Molecular Weight	168.1070
SMILES	OC(=O)C1=NC=CC=C1[N+]([O-])=O
Synonyms	59290-85-6, 3-NITROPYRIDINE-2-CARBOXYLIC ACID, 3-Nitro-pyridine-2-carboxylic acid, 3-Nitropicolinic acid, 2-Pyridinecarboxylic acid, 3-nitro-, nitropicolinic acid, 3-Nitro-Pyridine-2-CarboxylicAcid, PubChem17427, 2-carboxy-3-nitropyridine, SCHEMBL1232905, CTK1G9230, DTXSID60593261, ZUUJWCKWJJGJOE-UHFFFAOYSA-N, 2-Pyridinecarboxylicacid, 3-nitro-, KS-000003LM, AB1563, ANW-66608, CN-456, FCH853143, MFCD06658500, ZINC14983393, AKOS006293624, CM10478, PB26199, QC-6637, TRA0019764, VP14574, 3-NITRO-2-PYRIDINECARBOXYLIC ACID, AC-23562, AJ-65907, AK-35781, AN-39615, AS-44604, BC670781, OR345379, SY013589, AB0050991, AB1004308, AX8029171, ST2405168, TC-063192, AM20061364, CS-0044723, FT-0648646, V6820, C-8602, MFCD06658500 (97+%), 290N856, Picolinicacid, 3-nitro- (6CI); 2-Carboxy-3-nitropyridine; 3-Nitro-2-pyridinecarboxylicacid; 3-Nitropicolinic acid, C7H5FO2, (2S,5R)-2,5-dimethylmorpholine, ACN-028048, A8338, 1639924-58-5,

Complexity	200
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	168.017g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	168.108g/mol
Monoisotopic Mass	168.017g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	96A^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
UN Code

Certificate of Analysis

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