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CAS 936548-16-2

:

1-bromo-2-[isocyano(p-tolylsulfonyl)methyl]benzene

Description:
1-Bromo-2-[isocyano(p-tolylsulfonyl)methyl]benzene is a chemical compound characterized by its unique functional groups and structural features. It contains a bromine atom attached to a benzene ring, which is further substituted at the ortho position by an isocyanomethyl group that is linked to a p-tolylsulfonyl moiety. This compound exhibits properties typical of both aromatic and isocyanide functionalities, which can influence its reactivity and interactions in various chemical environments. The presence of the bromine atom may enhance electrophilic substitution reactions, while the isocyanide group can participate in nucleophilic addition reactions. Additionally, the sulfonyl group contributes to the compound's overall polarity and solubility characteristics. The compound's structure suggests potential applications in organic synthesis, particularly in the development of pharmaceuticals or agrochemicals, due to the reactivity of the isocyanide and the stability provided by the aromatic system. As with many organic compounds, safety and handling precautions should be observed, given the potential hazards associated with brominated and isocyanide compounds.
Formula:C15H12BrNO2S
InChI:InChI=1/C15H12BrNO2S/c1-11-7-9-12(10-8-11)20(18,19)15(17-2)13-5-3-4-6-14(13)16/h3-10,15H,1H3
SMILES:Cc1ccc(cc1)S(=O)(=O)C(c1ccccc1Br)[N+]#[C-]
Synonyms:
  • (2-Bromophenyl)(isocyano)methyl 4-methylphenyl sulfone
  • 1-Bromo-2-{isocyano[(4-methylphenyl)sulfonyl]methyl}benzene
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