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Cat. No. Size / Unit Price Qty
CS-W001157 4
Total: USD 88.00

2,3,4,5,6-Pentafluorobenzenesulfonyl chloride

  • CAS No. 832-53-1

  • Cat. No. CS-D1223
  • Purity≥95%
  • MDL No.MFCD00007427

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

2,3,4,5,6-Pentafluorobenzenesulfonyl chloride|CS-D1223

Structure of 832-53-1

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General Information

  • CAS No. 832-53-1
  • Cat. No. CS-D1223
  • Purity ≥95%
  • MDL No. MFCD00007427
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆ClF₅O₂S
  • Molecular Weight 266.57
  • Synonym(s) Pentafluorobenzenesulfonyl chloride; Pentafluorophenylsulfonyl chloride; Pentafluororbenzenesulfonyl chloride; Pentafluorobenzenesulphonyl chloride
  • SMILES ClS(C1=C(F)C(F)=C(F)C(F)=C1F)(=O)=O

Description

Pentafluorobenzenesulfonyl chloride reacts with benzene and thiophene derivatives in the presence of a ruthenium (II) catalyst to form corresponding perfluorophenylated compounds.Pentafluorobenzenesulfonyl chloride was used as derivatizing reagent for simultaneous determination of fluoxetine and p-trifluoromethylphenol, an O-dealkylated metabolite of fluoxetine in human liver microsomes. Pentafluorobenzenesulfonyl chloride was used for electrophore labeling of small tyrosyl peptides for their analysis by gas chromatography with electron-capture detection.

Synthesis

  • Route1
    • null|null
      363-72-4
    • ~53%
    • In-stock
      2,3,4,5,6-Pentafluorobenzenesulfonyl chloride|CS-D1223
      832-53-1

    References

    • Horner, Leopold; Schmitt, Rolf-Erhard Phosphorus and Sulfur and the Related Elements, 1982 , vol. 13, p. 189 - 212
  • Route2
    • null|null
      879-06-1
    • ~51%
    • In-stock
      2,3,4,5,6-Pentafluorobenzenesulfonyl chloride|CS-D1223
      832-53-1

    References

    • Chen, Qing-Yun; Chen, Ming-Fang Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999), 1991 , # 7 p. 1071 - 1075
  • Route3
    • null|null
      27918-31-6
    • null|null
      7722-84-1
    • ~46%
    • In-stock
      2,3,4,5,6-Pentafluorobenzenesulfonyl chloride|CS-D1223
      832-53-1

    References

    • Gmelin Handbook: F: PerFHalOrg.2, 1.3.4, page 137 - 166

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05
Signal Word : Danger
UN#: 3265
Class : 8
Packing Group : Ⅱ
Hazard Statements : H314
Precautionary Statements : P260-P264-P280-P301+P330+P331-P304+P340-P363-P405-P501

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Computational Chemistry Data

  • TPSA   34.14
  • LogP   2.3096
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   1

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