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CAS 952182-76-2

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Ethyl 3-(trifluoromethyl)-2-pyridinecarboxylate

Description:
Ethyl 3-(trifluoromethyl)-2-pyridinecarboxylate is an organic compound characterized by its pyridine ring, which is a six-membered aromatic heterocycle containing one nitrogen atom. The presence of a trifluoromethyl group (-CF3) at the 3-position of the pyridine ring significantly influences its chemical properties, enhancing its lipophilicity and potentially its reactivity. The ethyl ester functional group at the 2-position contributes to its solubility in organic solvents and can participate in various chemical reactions, such as esterification and nucleophilic substitution. This compound is typically used in synthetic organic chemistry, particularly in the development of pharmaceuticals and agrochemicals, due to its ability to serve as a building block for more complex molecules. Its unique electronic properties, imparted by the trifluoromethyl group, can also affect its biological activity and interaction with biological targets. Safety data should be consulted for handling, as compounds with trifluoromethyl groups can exhibit specific toxicological profiles.
Formula:C9H8F3NO2
InChI:InChI=1S/C9H8F3NO2/c1-2-15-8(14)7-6(9(10,11)12)4-3-5-13-7/h3-5H,2H2,1H3
InChI key:InChIKey=CNITUJQBBIMJBR-UHFFFAOYSA-N
SMILES:C(OCC)(=O)C1=C(C(F)(F)F)C=CC=N1
Synonyms:
  • Ethyl 3-(trifluoromethyl)-2-pyridinecarboxylate
  • 2-Pyridinecarboxylic acid, 3-(trifluoromethyl)-, ethyl ester
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