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CAS 1879026-08-0

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Methyl 2-bromo-6-fluoro-3-(methylthio)benzoate

Description:
Methyl 2-bromo-6-fluoro-3-(methylthio)benzoate is an organic compound characterized by its aromatic structure, which includes a benzoate moiety. The presence of bromine and fluorine substituents on the benzene ring contributes to its reactivity and potential applications in various chemical reactions, such as nucleophilic substitutions or coupling reactions. The methylthio group enhances its properties, potentially influencing solubility and reactivity. This compound is typically used in synthetic organic chemistry, particularly in the development of pharmaceuticals or agrochemicals, due to its unique functional groups that can participate in further chemical transformations. Its molecular structure suggests it may exhibit specific interactions with biological targets, making it of interest in medicinal chemistry. Additionally, the presence of halogens often imparts unique physical properties, such as altered boiling and melting points compared to non-halogenated analogs. Safety and handling precautions should be observed, as halogenated compounds can pose health risks and environmental concerns.
Formula:C9H8BrFO2S
InChI:InChI=1S/C9H8BrFO2S/c1-13-9(12)7-5(11)3-4-6(14-2)8(7)10/h3-4H,1-2H3
InChI key:InChIKey=RCEJVPKINUQTGT-UHFFFAOYSA-N
SMILES:C(OC)(=O)C1=C(Br)C(SC)=CC=C1F
Synonyms:
  • Methyl 2-bromo-6-fluoro-3-(methylthio)benzoate
  • Benzoic acid, 2-bromo-6-fluoro-3-(methylthio)-, methyl ester
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