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CAS 2187435-46-5

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1-(2-Bromoethynyl)-4-chloro-2-fluorobenzene

Description:
1-(2-Bromoethynyl)-4-chloro-2-fluorobenzene is an organic compound characterized by its unique structure, which includes a benzene ring substituted with a bromoethynyl group, a chlorine atom, and a fluorine atom. The presence of the ethynyl group introduces a triple bond, contributing to its reactivity and potential applications in organic synthesis. The chlorine and fluorine substituents enhance the compound's electrophilic properties, making it useful in various chemical reactions, including cross-coupling reactions and as a building block in the synthesis of more complex molecules. This compound is typically handled with care due to the presence of halogens, which can pose health and environmental risks. Its physical properties, such as boiling point, melting point, and solubility, are influenced by the substituents on the benzene ring, and it may exhibit unique spectral characteristics in techniques like NMR and IR spectroscopy. Overall, 1-(2-Bromoethynyl)-4-chloro-2-fluorobenzene is of interest in the fields of medicinal chemistry and materials science.
Formula:C8H3BrClF
InChI:InChI=1S/C8H3BrClF/c9-4-3-6-1-2-7(10)5-8(6)11/h1-2,5H
InChI key:InChIKey=UHMAEITVYQXLOJ-UHFFFAOYSA-N
SMILES:C(#CBr)C1=C(F)C=C(Cl)C=C1
Synonyms:
  • Benzene, 1-(2-bromoethynyl)-4-chloro-2-fluoro-
  • 1-(2-Bromoethynyl)-4-chloro-2-fluorobenzene
  • 1-(Bromoethynyl)-4-chloro-2-fluorobenzene
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