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CAS 175205-35-3

:

1-Bromo-4-fluoro-2-isothiocyanatobenzene

Description:
1-Bromo-4-fluoro-2-isothiocyanatobenzene is an organic compound characterized by the presence of a bromine atom, a fluorine atom, and an isothiocyanate functional group attached to a benzene ring. Its molecular structure features a benzene core with substituents at specific positions, which influence its reactivity and properties. The isothiocyanate group (-N=C=S) is known for its versatility in organic synthesis, particularly in the formation of thioureas and other derivatives. The presence of both bromine and fluorine introduces significant electronegativity differences, which can affect the compound's polarity and solubility in various solvents. This compound may exhibit biological activity, making it of interest in medicinal chemistry and agrochemicals. Additionally, its unique combination of halogen and isothiocyanate functionalities can lead to interesting reactivity patterns in chemical reactions, such as nucleophilic substitutions or cycloadditions. Overall, 1-Bromo-4-fluoro-2-isothiocyanatobenzene is a valuable compound in synthetic organic chemistry with potential applications in various fields.
Formula:C7H3BrFNS
InChI:InChI=1/C7H3BrFNS/c8-6-3-5(9)1-2-7(6)10-4-11/h1-3H
InChI key:InChIKey=LPYALAIWRFVCHN-UHFFFAOYSA-N
SMILES:N(=C=S)C1=C(Br)C=CC(F)=C1
Synonyms:
  • 1-Bromo-4-fluoro-2-isothiocyanatobenzene
  • 2-Bromo-4-Fluoro-1-Isothiocyanatobenzene
  • 2-Bromo-5-fluorophenyl isothiocyanate
  • Benzene, 1-bromo-4-fluoro-2-isothiocyanato-
  • Benzene, 1-bromo-4-fluoro-2-isothiocyanato- (9CI)
  • 2-BROMO-4-FLUOROPHENYL ISOTHIOCYANATE
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