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CAS 1214345-88-6

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4-Pyridinecarboxylic acid, 2-bromo-6-fluoro-, methyl ester

Description:
4-Pyridinecarboxylic acid, 2-bromo-6-fluoro-, methyl ester, identified by its CAS number 1214345-88-6, 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 bromine and fluorine substituents at the 2 and 6 positions of the pyridine ring, respectively, contributes to its unique chemical reactivity and potential applications in pharmaceuticals and agrochemicals. The bromine atom can enhance the compound's electrophilicity, while the fluorine atom may influence its lipophilicity and biological activity. This compound is likely to exhibit moderate solubility in organic solvents and may participate in various chemical reactions, including nucleophilic substitutions and coupling reactions. Its specific properties, such as melting point, boiling point, and spectral characteristics, would need to be determined through experimental methods or detailed literature review for precise applications.
Formula:C7H5BrFNO2
InChI:InChI=1S/C7H5BrFNO2/c1-12-7(11)4-2-5(8)10-6(9)3-4/h2-3H,1H3
InChI key:InChIKey=NSBCDAOTMXXBNC-UHFFFAOYSA-N
SMILES:C(OC)(=O)C=1C=C(Br)N=C(F)C1
Synonyms:
  • 4-Pyridinecarboxylic acid, 2-bromo-6-fluoro-, methyl ester
  • Methyl 2-bromo-6-fluoropyridine-4-carboxylate
  • methyl 2-bromo-6-fluoroisonicotinate
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