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CAS 54091-06-4

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1-bromo-4-[(chloromethyl)sulfonyl]benzene

Description:
1-Bromo-4-[(chloromethyl)sulfonyl]benzene, with the CAS number 54091-06-4, is an organic compound characterized by the presence of a bromine atom and a chloromethylsulfonyl group attached to a benzene ring. This compound features a sulfonyl functional group, which is known for its strong electron-withdrawing properties, enhancing the reactivity of the aromatic system. The bromine substituent can participate in nucleophilic substitution reactions, while the chloromethyl group can serve as a leaving group in various chemical transformations. The presence of both halogen atoms (bromine and chlorine) suggests potential applications in synthetic organic chemistry, particularly in the development of pharmaceuticals or agrochemicals. Additionally, the compound's structure indicates it may exhibit specific physical properties such as solubility in organic solvents and potential reactivity under certain conditions. Safety considerations should be taken into account due to the presence of halogens and the sulfonyl group, which may pose hazards in handling and disposal.
Formula:C14H10Br2Cl2O2S
InChI:InChI=1/C14H10Br2Cl2O2S/c15-11-5-1-9(2-6-11)13(17)21(19,20)14(18)10-3-7-12(16)8-4-10/h1-8,13-14H
InChI key:AHXUVTKVCMOKIX-UHFFFAOYSA-N
SMILES:c1cc(ccc1C(Cl)S(=O)(=O)C(c1ccc(cc1)Br)Cl)Br
Synonyms:
  • Benzene, 1-bromo-4-((chloromethyl)sulfonyl)-
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