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CAS Number: 1031417-48-7
3-(5-(trifluoromethyl)-1H-pyrazol-3-yl)benzoic acid

Structure

 3-(5-(trifluoromethyl)-1H-pyrazol-3-yl)benzoic acid
Name: 3-(5-(trifluoromethyl)-1H-pyrazol-3-yl)benzoic acid
Synonyms:
General Information
Product Number: 1031417487

CAS Registry Number 1031417-48-7
Name:
Benzoic acid, 3-?[5-?(trifluoromethyl)?-?1H-?pyrazol-?3-?yl]?-
3-[5-(Trifluoromethyl)-1H-pyrazol-3-yl]benzoic 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)9-5-8(15-16-9)6-2-1-3-7(4-6)10(17)18/h1-5H,(H,15,16)(H,17,18)

InChI Key:QMGFXUYCFYXWDD-UHFFFAOYSA-N

Canonical SMILES:C1=CC(=CC(=C1)C(=O)O)C2=NNC(=C2)C(F)(F)F

Specification

98%
References

PCT Int. Appl. (2008), WO 2008065508 A1 20080605.
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