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CS-W001157 4
Total: USD 88.00

3-Chloro-4-(chlorosulfonyl)benzoic acid

  • CAS No. 29872-68-2

  • Cat. No. CS-0264173
  • Purity95+%
  • MDL No.None

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

3-Chloro-4-(chlorosulfonyl)benzoic acid|CS-0264173

Structure of 29872-68-2

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General Information

  • CAS No. 29872-68-2
  • Cat. No. CS-0264173
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₄Cl₂O₄S
  • Molecular Weight 255.08
  • Synonym(s) 3-chloro-4-chlorosulfonyl-benzoic acid
  • SMILES O=C(O)C1=CC=C(S(=O)(Cl)=O)C(Cl)=C1

Synthesis

  • Route1
    • null|null
      7790-94-5
    • In-stock
      3-Chlorobenzoic acid|CS-0015123
      535-80-8
    • ~45%
    • null|null
      470691-29-3
    • 3-Chloro-4-(chlorosulfonyl)benzoic acid|CS-0264173
      29872-68-2

    References

    • SMITHKLINE BEECHAM CORPORATION Patent: WO2004/54974 A2, 2004 ; Location in patent: Page 436 ; WO 2004/054974 A2

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05,GHS07
Signal Word : Danger
UN#: 3261
Class : 8
Packing Group : Ⅲ
Hazard Statements : H314-H335
Precautionary Statements : P260-P261-P264-P271-P280-P301+P330+P331-P304+P340-P363-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   71.44
  • LogP   1.9657
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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