CAS:98534-81-7 / 1-phenyl-5-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid--Hangzhou Chempro Technology Co., Ltd.

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CAS Number: 98534-81-7
1-phenyl-5-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid

Structure
Name: 1-phenyl-5-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid
Synonyms:

General Information

Product Number: 98534817

CAS Registry Number 98534-81-7
Name:
1H-Pyrazole-4-carboxylic acid, 1-phenyl-5-(trifluoromethyl)-
1-Phenyl-5-trifluoromethyl-1H-pyrazole-4-carboxylic acid

Chemical Formula: C11H7F3N2O2
Exact Mass: 256.05
Molecular Weight: 256.18
m/z: 256.05 (100.0%), 257.05 (12.1%), 258.05 (1.2%)

InChI:InChI=1S/C11H7F3N2O2/c12-11(13,14)9-8(10(17)18)6-15-16(9)7-4-2-1-3-5-7/h1-6H,(H,17,18)

InChI Key:SMPJBTIFNUUWGQ-UHFFFAOYSA-N

Canonical SMILES:C1=CC=C(C=C1)N2C(=C(C=N2)C(=O)O)C(F)(F)F

Thermal Properties	Value	Condition	Note
Melting Point	132-134 °C	Solv: hexane (110-54-3); chloroform (67-66-3)	(2)CAS
Melting Point	129-131 °C		(3)IC

Specification

98%

References

(2) Schlosser, Manfred; European Journal of Organic Chemistry 2002, (17), P2913-2920 CAPLUS
(3) Beck, James R.; Journal of Heterocyclic Chemistry 1987, V24(3), P739-40 CAPLUS

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