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CAS Number: 878742-59-7
2-(trifluoromethyl)pyrimidine-4-carboxylic acid

Structure

2-(trifluoromethyl)pyrimidine-4-carboxylic acid
Name: 2-(trifluoromethyl)pyrimidine-4-carboxylic acid
Synonyms:
General Information
Product Number: 878742597
CAS Registry Number: 878742-59-7
Name:
        4-​Pyrimidinecarboxylic acid, 2-​(trifluoromethyl)​-
        2-​(Trifluoromethyl)​pyrimidine-​4-​carboxylic acid 
 
Chemical Formula: C6H3F3N2O2
Exact Mass: 192.01
Molecular Weight: 192.10
m/z: 192.01 (100.0%), 193.02 (6.6%)
Elemental Analysis: C, 37.51; H, 1.57; F, 29.67; N, 14.58; O, 16.66
 
InChI: InChI=1S/C6H3F3N2O2/c7-6(8,9)5-10-2-1-3(11-5)4(12)13/h1-2H,(H,12,13)
InChIKey: HGFBZPMMYNDNLR-UHFFFAOYSA-N
Canonical SMILES : C1=CN=C(N=C1C(=O)O)C(F)(F)F

Specification

98%

References

PCT Int. Appl. (2014), WO 2014062938 A1 20140424.

PCT Int. Appl. (2013), WO 2013087805 A1 20130620.

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