AG003TS2

824-40-8 | PICOLINIC ACID N-OXIDE

AG003TS2

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CAS Number	824-40-8
Catalog Number	AG003TS2(AGN-PC-0JL9EB)
Chemical Name	PICOLINIC ACID N-OXIDE
EC Number	212-528-0
IUPAC Name	1-oxidopyridin-1-ium-2-carboxylic acid
InChI	InChI=1S/C6H5NO3/c8-6(9)5-3-1-2-4-7(5)10/h1-4H,(H,8,9)
InChI Key	FHYMLBVGNFVFBT-UHFFFAOYSA-N
MDL Number	MFCD00006198
Molecular Formula	C6H5NO3
Molecular Weight	139.1088
NSC Number	27961
SMILES	O=C(O)C1=CC=CC=[N+]1[O-]
Synonyms	Picolinic acid N-oxide, 824-40-8, Pyridine-2-carboxylic acid 1-oxide, 2-carboxypyridin-1-ium-1-olate, 2-Carboxypyridine N-oxide, 2-Pyridinecarboxylic acid, 1-oxide, Picolinic acid 1-oxide, CHEMBL73173, Picolinic acid N-oxide, 97%, 2-Pyridinecarboxylicacid, 1-oxide, picolinate n-oxide, 1-Oxopicolinic acid, 2-Picolinic acid-n-oxide, 2-Carboxypyridine 1-Oxide, AC1L2D3Z, 2-Pyridinecarboxylic acid oxide, AC1Q222F, AC1Q721L, SCHEMBL1489277, CTK3E8278, DTXSID40231715, FHYMLBVGNFVFBT-UHFFFAOYSA-N, ZINC331776, 1-hydroxypyridine-2-carboxylic acid, 2-Carboxylic acid-pyridine-1-oxide, NSC27961, Pyridine-2-carboxylic acid N-oxide, BDBM50403312, MFCD00006198, NSC-27961, SBB004183, AKOS004896823, NE10430, 1-oxidopyridin-1-ium-2-carboxylic acid, BP-13073, AB1011917, Y5050, AC-907/25014369, J-640108, J-800110, Z1270312063, 2-Pyridinecarboxylicacid, 1-oxide; Picolinicacid, 1-oxide; 1-Oxopicolinic acid; 2-Carboxylicacid-pyridine-1-oxide; 2-Carboxypyridine N-oxide, Picolinic acid, 1-oxide, PICOLINICACIDN-OXIDE, C6H5NO3, C6-H5-N-O3, trans 3-(3-indolyl)propenoic acid, CID69986, EINECS 212-528-0, AR-1L2748, 87071-16-7,

Complexity	137
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	139.027g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	139.11g/mol
Monoisotopic Mass	139.027g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	62.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H315-H319-H335
Precuationary statements	P261-P305+P351+P338
Siginal words

Certificate of Analysis

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