AG0079W0

374064-01-4 | 3-(Pyridin-3-yl)-1H-pyrazole-5-carboxylic acid

AG0079W0

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CAS Number	374064-01-4
Catalog Number	AG0079W0(AGN-PC-0KPYTR)
Chemical Name	3-(Pyridin-3-yl)-1H-pyrazole-5-carboxylic acid
IUPAC Name	3-pyridin-3-yl-1H-pyrazole-5-carboxylic acid
InChI	InChI=1S/C9H7N3O2/c13-9(14)8-4-7(11-12-8)6-2-1-3-10-5-6/h1-5H,(H,11,12)(H,13,14)
InChI Key	VZCDZCUPZRFWAW-UHFFFAOYSA-N
MDL Number	MFCD05170031
Molecular Formula	C9H7N3O2
Molecular Weight	189.1708
SMILES	O=C(C1=CC(C2=CC=CN=C2)=NN1)O
Synonyms	374064-01-4, 5-Pyridin-3-yl-1H-pyrazole-3-carboxylic acid, 3-(pyridin-3-yl)-1H-pyrazole-5-carboxylic acid, 5-(pyridin-3-yl)-1H-pyrazole-3-carboxylic acid, 3-pyridin-3-yl-1H-pyrazole-5-carboxylic acid, 5-(3-Pyridinyl)-1H-pyrazole-3-carboxylic acid, 5-(3-pyridyl)pyrazole-3-carboxylic acid, 3-pyridin-3-yl-1H-pyrazole-5-carboxylic acid hydrochloride, PubChem7847, AC1MKMMJ, BAS 10157056, SCHEMBL1759178, CTK1C2120, DTXSID40390255, VZCDZCUPZRFWAW-UHFFFAOYSA-N, ALBB-009734, BCP11614, KS-00000K3C, ZINC4384472, ANW-63037, BBL031756, CP-484, SBB010788, STK400216, AKOS000141789, AKOS000349345, AB21565, CS-W005916, GL-0038, MCULE-3725955651, QC-1249, RP24896, WT82678, AC-28046, AJ-66724, AK-95828, DS-18046, AB0033173, DB-069533, ST4143509, BB 0221314, FT-0677799, ST24041664, X6646, 5-Pyridin-3-yl-1H-pyrazole-3-carboxylicacid, 5-Pyridin-3-yl-2H-pyrazole-3-carboxylic acid, C-1611, 3-(3-pyridinyl)-1H-pyrazole-5-carboxylic acid, 1H-Pyrazole-3-carboxylicacid, 5-(3-pyridinyl)-, A823630, 1H-Pyrazole-3-carboxylic acid, 5-(3-pyridinyl)-, I04-5453, J-517936, F1967-0098, Z277051398, 5-Pyridin-3-yl-1H-pyrazole-3-carboxylic acid, AldrichCPR, 1H-pyrazole-5-carboxylic acid, 3-(3-pyridinyl)-, hydrochloride, C9H7N3O2, CID3159715, T1237, 3-(Pyridin-3-yl)-1H-pyrazole-5-carboxylicacid, 3-(3-pyridinyl)-1H-pyrazole-5-carboxylic acid hydrochloride, 5-(Pyridin-3-yl)-1H-pyrazole-3-carboxylic acid, 98% - 1G 1g, 1093636-79-3,

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	2
Isotope Atom Count	0
Molecular Weight	189.174g/mol
Monoisotopic Mass	189.054g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	78.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

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