CAS Registry Number: 131747-41-6

Name:

4-​Pyridinecarboxylic acid, 2-​(trifluoromethyl)​-
2-​(Trifluoromethyl)​isonicotinic acid; 2-​Trifluoromethylpyrid​ine-​4-​carboxylic acid 

Chemical Formula: C7H4F3NO2
Exact Mass: 191.02
Molecular Weight: 191.11
m/z: 191.02 (100.0%), 192.02 (8.0%)
Elemental Analysis: C, 43.99; H, 2.11; F, 29.82; N, 7.33; O, 16.74

InChI: InChI=1S/C7H4F3NO2/c8-7(9,10)5-3-4(6(12)13)1-2-11-5/h1-3H,(H,12,13)
InChIKey: BZFGKBQHQJVAHS-UHFFFAOYSA-N
Canonical SMILES : C1=CN=C(C=C1C(=O)O)C(F)(F)F

Specification

98%

1. (1) Cottet, Fabrice; European Journal of Organic Chemistry 2003, (8), P1559-1568 CAPLUS