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CAS Number: 438450-39-6
1-(3-chloropyridin-2-yl)-3-(trifluoromethyl)-1H-pyrazole-5-carboxylic acid

Structure

 1-(3-chloropyridin-2-yl)-3-(trifluoromethyl)-1H-pyrazole-5-carboxylic acid
Name: 1-(3-chloropyridin-2-yl)-3-(trifluoromethyl)-1H-pyrazole-5-carboxylic acid
Synonyms:
General Information
Product Number: 438450396

CAS Registry Number 438450-39-6
Name:
1H-?Pyrazole-?5-?carboxylic acid, 1-?(3-?chloro-?2-?pyridinyl)?-?3-?(trifluoromethyl)?-
1-(3-Chloro-2-pyridinyl)-3-(trifluoromethyl)-1H-pyrazole-5-carboxylic acid

 

Chemical Formula: C10H5ClF3N3O2
Exact Mass: 291.00
Molecular Weight: 291.61
m/z: 291.00 (100.0%), 293.00 (32.1%), 292.01 (10.9%), 294.00 (3.8%), 292.00 (1.1%)

 

InChI:InChI=1S/C10H5ClF3N3O2/c11-5-2-1-3-15-8(5)17-6(9(18)19)4-7(16-17)10(12,13)14/h1-4H,(H,18,19)

InChI Key:CCXJCKFHRYPKEP-UHFFFAOYSA-N

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

 

Thermal Properties Value Condition Note
Melting Point 178-179 °C   (1)CAS(1) Annis, Gary David; WO 2003016282 A2 2003 CAPLUS

Specification

98%
References

(1) Annis, Gary David; WO 2003016282 A2 2003 CAPLUS
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