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CS-W001157 4
Total: USD 88.00

4-Iodobenzenesulfonamide

  • CAS No. 825-86-5

  • Cat. No. CS-0187021
  • Molecule weight283.09
  • Purity≥97%
  • MDL No.None

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

4-Iodobenzenesulfonamide|CS-0187021

Structure of 825-86-5

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General Information

  • CAS No. 825-86-5
  • Cat. No. CS-0187021
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₆INO₂S
  • Molecular Weight 283.09
  • Synonym(s) None
  • SMILES C1=C(C=CC(=C1)S(=O)(=O)N)I

Application

4-Iodobenzenesulfonamide serves as a versatile building block in medicinal chemistry, enabling palladium-catalyzed cross-coupling reactions due to its stable iodide functionality. The sulfonamide group provides enhanced solubility and hydrogen-bonding capacity, facilitating target engagement in biological assays. Its bench-stable nature and compatibility with standard synthetic workflows make it ideal for constructing bioactive heterocycles and drug-like scaffolds.

Synthesis

  • Route1

    References

    • Mei, Hua; Desmarteau, Darryl D. Journal of Fluorine Chemistry, 2014 , vol. 160, p. 12 - 15
  • Route2

    References

    • Cerezo, Silvia; Cortes, Jordi; Galvan, David; Lago, Elena; Marchi, Caroline; Molins, Elies; Moreno-Manas, Marcial; Pleixats, Roser; Torrejon, Javier; Vallribera, Adelina European Journal of Organic Chemistry, 2001 , # 2 p. 329 - 337

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   60.16
  • LogP   0.9386
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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