AG003MZ0

253315-22-9 | 6-(1H-PYRAZOL-1-YL)NICOTINIC ACID

AG003MZ0

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CAS Number	253315-22-9
Catalog Number	AG003MZ0(AGN-PC-0KKPNN)
Chemical Name	6-(1H-PYRAZOL-1-YL)NICOTINIC ACID
IUPAC Name	6-pyrazol-1-ylpyridine-3-carboxylic acid
InChI	InChI=1S/C9H7N3O2/c13-9(14)7-2-3-8(10-6-7)12-5-1-4-11-12/h1-6H,(H,13,14)
InChI Key	QWFKXYLAKWFQLF-UHFFFAOYSA-N
MDL Number	MFCD00140749
Molecular Formula	C9H7N3O2
Molecular Weight	189.1708
SMILES	OC(=O)C1=CN=C(C=C1)N1C=CC=N1
Synonyms	6-(1H-pyrazol-1-yl)nicotinic acid, 253315-22-9, 6-(1H-Pyrazol-1-Yl)Pyridine-3-Carboxylic Acid, 6-pyrazol-1-ylpyridine-3-carboxylic Acid, 6-PYRAZOL-1-YL-NICOTINIC ACID, MFCD00140749, 6-pyrazolylpyridine-3-carboxylic acid, pyrazolylnicotinicacid, AC1MC8KA, AC1Q73BP, AC1Q73YE, Oprea1_423239, 6-pyrazol-1-ylnicotinic acid, MLS000755370, 6-Pyrazol-1-yl-nicotinicacid, SCHEMBL322839, 6-pyrazole-1-yl-nicotinic acid, CHEMBL1353628, CTK1A1272, DTXSID70377054, QWFKXYLAKWFQLF-UHFFFAOYSA-N, HMS2616M05, ZINC168240, 6-(1H-pyrazol-1yl)nicotinic acid, ACN-P000957, KS-00000KH3, ANW-59581, BBL011266, CP-841, SBB018001, STK939474, TD8137, 6-(1h-pyrazol-1-yl) nicotinic acid, AKOS000263291, 2F-330S, MCULE-4045185055, RP11198, RTR-011583, TRA0041725, AC-28047, AJ-16812, AK-48073, SMR000337758, TR-011583, 4CH-021642, 6-(pyrazol-1-yl)pyridine-3-carboxylic acid, BB 0218460, FT-0083098, FT-0645340, ST24045008, ST50530252, Z3007, EN300-27257, C-1154, 6-(1H-Pyrazol-1-yl)nicotinic acid, AldrichCPR, 6-(1H-Pyrazole-1-yl)pyridine-3-carboxylic acid, 3-Pyridinecarboxylicacid, 6-(1H-pyrazol-1-yl)-, 315P229, 3-Pyridinecarboxylic acid, 6-(1H-pyrazol-1-yl)-, I02-3864, J-517981, Z235344797, C9H7N3O2, ACN-000957, CID2763614, 6-(1H-Pyrazol-1-yl)nicotinic acid, 97% - 1G 1g,

Complexity	222
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	189.054g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	189.174g/mol
Monoisotopic Mass	189.054g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	68A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.7

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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