CAS 1211592-60-7

4-Pyridinecarboxylic acid, 5-chloro-2-(trifluoromethyl)-, methyl ester

Description:

4-Pyridinecarboxylic acid, 5-chloro-2-(trifluoromethyl)-, methyl ester, with CAS number 1211592-60-7, is an organic compound characterized by its pyridine ring structure, which is a six-membered aromatic ring containing one nitrogen atom. This compound features a carboxylic acid functional group that has been esterified with methanol, resulting in a methyl ester. The presence of a chloro substituent at the 5-position and a trifluoromethyl group at the 2-position of the pyridine ring significantly influences its chemical properties, including its reactivity and polarity. The trifluoromethyl group is known for imparting unique electronic properties, making the compound potentially useful in various chemical applications, including pharmaceuticals and agrochemicals. Additionally, the compound's solubility, stability, and reactivity can be affected by the presence of these substituents, which may also influence its biological activity. Overall, this compound represents a class of halogenated and fluorinated organic molecules that are of interest in synthetic chemistry and material science.

Formula: C₈H₅ClF₃NO₂

InChI: InChI=1S/C8H5ClF3NO2/c1-15-7(14)4-2-6(8(10,11)12)13-3-5(4)9/h2-3H,1H3

InChI key: InChIKey=XYCCAGXQLOJICJ-UHFFFAOYSA-N

SMILES: C(OC)(=O)C=1C=C(C(F)(F)F)N=CC1Cl

Synonyms:

• Methyl 5-chloro-2-(trifluoromethyl)pyridine-4-carboxylate
• 4-Pyridinecarboxylic acid, 5-chloro-2-(trifluoromethyl)-, methyl ester