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CS-W001157 4
Total: USD 88.00

3-Bromo-4-methoxybenzene-1-sulfonyl chloride

  • CAS No. 23094-96-4

  • Cat. No. CS-0150573
  • Molecule weight285.54
  • Purity≥97%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

3-Bromo-4-methoxybenzene-1-sulfonyl chloride|CS-0150573

Structure of 23094-96-4

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General Information

  • CAS No. 23094-96-4
  • Cat. No. CS-0150573
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₆BrClO₃S
  • Molecular Weight 285.54
  • Synonym(s) Benzenesulfonyl chloride, 3-bromo-4-methoxy-
  • SMILES COC1=C(C=C(C=C1)S(=O)(=O)Cl)Br

Description

3-Bromo-4-methoxybenzene-1-sulfonyl chloride features a brominated aromatic ring paired with a methoxy group and a reactive sulfonyl chloride moiety. This combination enables selective coupling in synthetic transformations, particularly in the construction of sulfonamide-based pharmaceutical intermediates under mild conditions.

Application

3-Bromo-4-methoxybenzene-1-sulfonyl chloride serves as a versatile building block for sulfonamide synthesis, enabling efficient incorporation of bromo- and methoxy-substituted arylsulfonyl groups into pharmaceutical intermediates. Its reactivity profile supports direct coupling with amines under mild conditions, offering high functional group tolerance and straightforward purification. The molecule exhibits good bench stability and is compatible with standard reaction workflows in medicinal chemistry and process development.

Synthesis

  • Route1

    References

    • AXYS PHARMACEUTICALS, INC. Patent: WO2004/62661 A1, 2004 ; Location in patent: Page/Page column 24-25; 37-38 ; WO 2004/062661 A1

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05,GHS07
Signal Word : Danger
UN#: 3261
Class : 8
Packing Group : Ⅱ
Hazard Statements : H302-H314
Precautionary Statements : P260-P264-P270-P280-P301+P330+P331-P304+P340-P330-P363-P405-P501

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Computational Chemistry Data

  • TPSA   43.37
  • LogP   2.3852
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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