AG004GI9

870704-22-6 | 5-(4-Fluorophenyl)-1H-pyrazole-3-carboxylic acid

AG004GI9

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CAS Number	870704-22-6
Catalog Number	AG004GI9(AGN-PC-0OKSOF)
Chemical Name	5-(4-Fluorophenyl)-1H-pyrazole-3-carboxylic acid
IUPAC Name	3-(4-fluorophenyl)-1H-pyrazole-5-carboxylic acid
InChI	InChI=1S/C10H7FN2O2/c11-7-3-1-6(2-4-7)8-5-9(10(14)15)13-12-8/h1-5H,(H,12,13)(H,14,15)
InChI Key	FDNYHBASQZFVBL-UHFFFAOYSA-N
MDL Number	MFCD04073723
Molecular Formula	C10H7FN2O2
Molecular Weight	206.1732
SMILES	FC1=CC=C(C=C1)C2=CC(=N[NH]2)C(=O)O
Synonyms	5-(4-fluorophenyl)-1H-pyrazole-3-carboxylic acid, 870704-22-6, 3-(4-fluorophenyl)-1H-pyrazole-5-carboxylic acid, 5-(4-Fluoro-phenyl)-2H-pyrazole-3-carboxylic acid, BAS 06804310, 890006-82-3, MLS-0091974.0001, 5-(4-fluoro-phenyl)-1H-pyrazole-3-carboxylic acid, 3-(4-fluorophenyl)pyrazole-5-carboxylic acid, AC1LIYG3, AC1Q72XI, SCHEMBL70800, AC1Q747W, cid_940540, CHEMBL1604946, BDBM45821, CTK3E6178, CTK3E7203, TOS-BB-0271, FDNYHBASQZFVBL-UHFFFAOYSA-N, ACN-P001042, ACT01787, ALBB-006692, BCP16522, KS-000019JB, ZINC4244835, 5190AH, ANW-51014, BBL008304, MFCD03420242, RW2317, SBB006939, STK347689, AKOS000137856, AKOS000266409, AB14517, BS-4166, DS-0119, FS-1877, MCULE-6583073909, RTR-027100, AJ-70505, AK-17516, BR-17516, AB0027137, DB-001694, TC-139759, 4CH-006493, AM20060798, AM20061228, BB 0219047, CS-0038334, FT-0717477, ST24032870, ST45115856, W8935, EN300-36320, L-3429, S-4091, 1H-Pyrazole-3-carboxylicacid,5-(4-fluorophenyl)-, 5-(4-fluorophenyl)-2H-pyrazole-3-carboxylic acid, 1H-Pyrazole-3-carboxylicacid, 5-(4-fluorophenyl)-, 5-(4-fluoro-phenyl)-2 h-pyrazole-3-carboxylic acid, 3-(4-Fluorophenyl)-1H-pyrazole-5-carboxylic acid, 97%, F3250-0571, Z367678704, 5-(4-Fluorophenyl)-1H-pyrazole-3-carboxylic acid, AldrichCPR, 3-Aminopyridazine hydrochloride, C10H7FN2O2, CID940540, 5- -1H-PYRAZOLE-3-CARBOXYLICACID, 5-(4-chlorophenyl)-1H-pyrazole-3-carboxylic acid, 5-(4-Fluorophenyl)-1H-pyrazole-3-carboxylicacid, 2-BROMO-4,5-DIMETHYL-1,3-THIAZOLE HYDROBROMIDE, 89166-98-3, 89203-22-5,

Complexity	242
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	206.049g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	206.176g/mol
Monoisotopic Mass	206.049g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	66A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H319
Packing Group
Precautionary statements	P305+P351+P338
UN Code

Certificate of Analysis

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