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CS-W001157 4
Total: USD 88.00

2,4-Dichloro-5-chlorosulfonyl-benzoic acid

  • CAS No. 3740-18-9

  • Cat. No. CS-0207505
  • Purity≥95%
  • MDL No.MFCD00486543

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

2,4-Dichloro-5-chlorosulfonyl-benzoic acid|CS-0207505

Structure of 3740-18-9

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General Information

  • CAS No. 3740-18-9
  • Cat. No. CS-0207505
  • Purity ≥95%
  • MDL No. MFCD00486543
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₃Cl₃O₄S
  • Molecular Weight 289.52
  • Synonym(s) 2,4-Dichloro-5-(chlorosulphonyl)benzoic acid
  • SMILES C1=C(C(=CC(=C1S(=O)(=O)Cl)Cl)Cl)C(=O)O

Synthesis

  • Route1
    • 2,4-Dichlorobenzoic acid Furosemide Impurity|CS-0229669
      50-84-0
    • ~74%
    • 2,4-Dichloro-5-chlorosulfonyl-benzoic acid|CS-0207505
      3740-18-9

    References

    • Hrast, Martina; Turk, Samo; Sosic, Izidor; Knez, Damijan; Randall, Christopher P.; Barreteau, Helene; Contreras-Martel, Carlos; Dessen, Andrea; O'Neill, Alex J.; Mengin-Lecreulx, Dominique; Blanot, Didier; Gobec, Stanislav European Journal of Medicinal Chemistry, 2013 , vol. 66, p. 32 - 45
  • Route2
    • null|null
      7790-94-5
    • 2,4-Dichlorobenzoic acid Furosemide Impurity|CS-0229669
      50-84-0
    • ~56%
    • 2,4-Dichloro-5-chlorosulfonyl-benzoic acid|CS-0207505
      3740-18-9

    References

    • ASTRAZENECA; NPS PHARMACEUTICALS, INC. Patent: WO2004/92135 A2, 2004 ; Location in patent: Page 30-31 ; WO 2004/092135 A2

Safety Information

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

Quality Control

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Computational Chemistry Data

  • TPSA   71.44
  • LogP   2.6191
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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