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CAS 81171-71-3

:

4-bromo-2-fluoro-1-isothiocyanatobenzene

Description:
4-Bromo-2-fluoro-1-isothiocyanatobenzene, with the CAS number 81171-71-3, is an organic compound that belongs to the class of isothiocyanates. It features a benzene ring substituted with a bromine atom at the para position, a fluorine atom at the ortho position, and an isothiocyanate group (-N=C=S) at the meta position. This compound is characterized by its aromatic nature, which contributes to its stability and reactivity. The presence of both bromine and fluorine atoms introduces significant electronegativity differences, influencing its chemical behavior and potential interactions with other molecules. Isothiocyanates are known for their biological activity, including potential antimicrobial and anticancer properties. The compound may be used in various applications, including organic synthesis and as a building block in the development of pharmaceuticals or agrochemicals. Its unique combination of halogen substituents and the isothiocyanate functional group makes it a subject of interest in both synthetic and medicinal chemistry.
Formula:C7H3BrFNS
InChI:InChI=1/C7H3BrFNS/c8-5-1-2-7(10-4-11)6(9)3-5/h1-3H
SMILES:c1cc(c(cc1Br)F)N=C=S
Synonyms:
  • Benzene, 4-bromo-2-fluoro-1-isothiocyanato-
  • 4-Bromo-2-fluoro-1-isothiocyanatobenzene
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Found 4 products.