AG0008FZ

1134-50-5 | 1H-Pyrazole-4-carboxylic acid, 1-phenyl-

AG0008FZ

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CAS Number	1134-50-5
Catalog Number	AG0008FZ(AGN-PC-0JLN96)
Chemical Name	1H-Pyrazole-4-carboxylic acid, 1-phenyl-
IUPAC Name	1-phenylpyrazole-4-carboxylic acid
InChI	InChI=1S/C10H8N2O2/c13-10(14)8-6-11-12(7-8)9-4-2-1-3-5-9/h1-7H,(H,13,14)
InChI Key	ZROILLPDIUNLSE-UHFFFAOYSA-N
MDL Number	MFCD00514518
Molecular Formula	C10H8N2O2
Molecular Weight	188.1827
SMILES	O=C(C1=CN(C2=CC=CC=C2)N=C1)O
Synonyms	1-Phenyl-1H-pyrazole-4-carboxylic acid, 1134-50-5, 1-Phenylpyrazole-4-carboxylic acid, Pyrazole-4-carboxylic acid, 1-phenyl-, BRN 0139486, 1H-Pyrazole-4-carboxylic acid, 1-phenyl-, ZROILLPDIUNLSE-UHFFFAOYSA-N, MFCD00514518, 1-Phenyl-1h-pyrazol-4-carboxylic acid, 1-phenylpyrazole-4-carboxylate, Pyrazole, 1, 1-Phenyl-1H-pyrazole-4-carboxylicacid, akos pao-0321, AC1L3RYD, AC1Q73XN, ACMC-1C9E6, SCHEMBL70281, 5-25-04-00056 (Beilstein Handbook Reference), 1-phenylpyrazole-4-carboxylic, asinex-reag bas 16289592, CHEMBL406105, BDBM21615, CTK0H8017, DTXSID20150399, 1-phenyl-pyrazole-4-carboxylicaci, HMS1741L17, HMS3604M12, 1-phenyl-4-pyrazolecarboxylic acid, ACT07623, ALBB-000149, KS-00003KT5, ZINC4218283, ANW-72862, BBL012453, SBB014249, STK414996, AKOS000206849, AB06399, AS06559, CM10524, DB08790, FS-3391, MCULE-7197599645, RP03570, RTR-045335, VP20045, 1H-Pyrazole-4-carboxylicacid, 1-phenyl-, AJ-49034, AK-32875, AN-48688, BAS 16289592, BR-32875, 1-Phenyl-1H-pyrazole-4-carboxylic acid #, AB0034836, LS-128381, ST2408862, ST4133997, TR-045335, 4CH-012733, AM20020222, BB 0219785, FT-0649573, X9057, EN300-14398, C-1240, 1H-PYRAZOLE-4-CARBOXYLIC ACID, 1-PHENYL, 514P518, W-204816, Z99601182, 1-phenyl-1h-pyrazole-4-carboxylic acid(saltdata: free), ZZA, Lioresal, 1H-Pyrazole-4-carboxylic acid, C10H8N2O2, C10-H8-N2-O2, CID121026, 1-Methoxy-1-methylamino-2-nitroethylene, A2307, beta-(Aminomethyl)-4-chlorobenzenepropanoic acid, 1-(4-AMINOPHENOXY)-3-(1H-IMIDAZOL-1-YL)-2-PROPANOL,

Complexity	214
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	188.059g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	188.186g/mol
Monoisotopic Mass	188.059g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	55.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

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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