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CAS 183995-72-4

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2-Bromo-4-fluoro-1-isothiocyanatobenzene

Description:
2-Bromo-4-fluoro-1-isothiocyanatobenzene, with the CAS number 183995-72-4, is an organic compound that features a benzene ring substituted with a bromine atom, a fluorine atom, and an isothiocyanate group. This compound is characterized by its aromatic structure, which contributes to its stability and reactivity. The presence of the isothiocyanate functional group (-N=C=S) indicates potential for nucleophilic reactions, making it useful in various synthetic applications, particularly in medicinal chemistry and material science. The bromine and fluorine substituents can influence the electronic properties of the molecule, affecting its reactivity and interaction with biological targets. Additionally, the compound may exhibit specific physical properties such as solubility in organic solvents and distinct melting or boiling points, which are typical for halogenated aromatic compounds. Safety precautions should be taken when handling this substance, as isothiocyanates can be irritants and may pose health risks. Overall, 2-Bromo-4-fluoro-1-isothiocyanatobenzene is a valuable compound in chemical research and development.
Formula:C7H3BrFNS
InChI:InChI=1S/C7H3BrFNS/c8-6-3-5(9)1-2-7(6)10-4-11/h1-3H
InChI key:InChIKey=SSLVXFSUADEZBQ-UHFFFAOYSA-N
SMILES:N(=C=S)C1=C(Br)C=C(F)C=C1
Synonyms:
  • 2-Bromo-4-fluorophenylisothiocyanate
  • 2-Bromo-4-fluoro-1-isothiocyanatobenzene
  • Benzene, 2-bromo-4-fluoro-1-isothiocyanato-
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