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CAS 395664-58-1

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2-Thiophenecarboxylic acid, 4,5-dibromo-3-fluoro-, methyl ester

Description:
2-Thiophenecarboxylic acid, 4,5-dibromo-3-fluoro-, methyl ester, identified by CAS number 395664-58-1, is an organic compound characterized by its thiophene ring structure, which is a five-membered aromatic heterocycle containing sulfur. 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 4, 5, and 3 positions, respectively, introduces significant electronegative elements, which can influence the compound's reactivity and polarity. Typically, such halogenated compounds exhibit enhanced biological activity and can serve as intermediates in the synthesis of pharmaceuticals or agrochemicals. The compound is likely to be a solid at room temperature, with potential applications in various fields, including materials science and medicinal chemistry. Its unique combination of functional groups and substituents may also impart specific properties such as increased lipophilicity or altered solubility in organic solvents. Safety and handling precautions should be observed due to the presence of halogens, which can pose health risks.
Formula:C6H3Br2FO2S
InChI:InChI=1S/C6H3Br2FO2S/c1-11-6(10)4-3(9)2(7)5(8)12-4/h1H3
InChI key:InChIKey=CUZHIRPKCADYDJ-UHFFFAOYSA-N
SMILES:C(OC)(=O)C1=C(F)C(Br)=C(Br)S1
Synonyms:
  • 4,5-Dibromo-3-fluorothiophene-2-carboxylic acid methyl ester
  • 2-Thiophenecarboxylic acid, 4,5-dibromo-3-fluoro-, methyl ester
  • Methyl 4,5-dibromo-3-fluoro-2-thiophenecarboxylate
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