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CS-W001157 4
Total: USD 88.00

3-Iodobenzenesulfonicacid

  • CAS No. 50702-37-9

  • Cat. No. CS-0171143
  • Purity≥95%
  • MDL No.None

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

3-Iodobenzenesulfonicacid|CS-0171143

Structure of 50702-37-9

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General Information

  • CAS No. 50702-37-9
  • Cat. No. CS-0171143
  • Purity ≥95%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₅IO₃S
  • Molecular Weight 284.07
  • Synonym(s) 3-iodobenzenesulfonic Acid
  • SMILES C1=CC(=CC(=C1)S(=O)(=O)O)I

Synthesis

  • Route1
    • 3-Aminobenzenesulfonic acid Neostigmine  Impurity|CS-0229396
      121-47-1
    • ~30%
    • 3-Iodobenzenesulfonicacid|CS-0171143
      50702-37-9

    References

    • 3-Dimensional Pharmaceuticals, Inc. Patent: US6420397 B1, 2002 ;
  • Route2
    • null|null
      13110-98-0
    • ~%
    • 3-Iodobenzenesulfonicacid|CS-0171143
      50702-37-9

    References

    • Boyle Journal of the Chemical Society, 1909 , vol. 95, p. 1708
  • Route3
    • null|null
      121-57-3
    • ~%
    • 3-Iodobenzenesulfonicacid|CS-0171143
      50702-37-9

    References

    • Boyle Journal of the Chemical Society, 1909 , vol. 95, p. 1708

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   54.37
  • LogP   1.5379
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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