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CS-W001157 4
Total: USD 88.00

2,3,4,5,6-Pentafluorophenyl 4-methylbenzenesulfonate

  • CAS No. 2069-36-5

  • Cat. No. CS-0205912
  • Molecule weight338.25
  • Purity≥97%
  • MDL No.MFCD00060056

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

2,3,4,5,6-Pentafluorophenyl 4-methylbenzenesulfonate|CS-0205912

Structure of 2069-36-5

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General Information

  • CAS No. 2069-36-5
  • Cat. No. CS-0205912
  • Purity ≥97%
  • MDL No. MFCD00060056
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₇F₅O₃S
  • Molecular Weight 338.25
  • Synonym(s) Phenol,2,3,4,5,6-pentafluoro-,4-methylbenzenesulfonate
  • SMILES CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C(=C(C(=C2F)F)F)F)F

Synthesis

  • Route1

    References

    • Caddick, Stephen; Wilden, Jonathan D.; Judd, Duncan B. Journal of the American Chemical Society, 2004 , vol. 126, # 4 p. 1024 - 1025
  • Route2
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    • 2,3,4,5,6-Pentafluorophenyl 4-methylbenzenesulfonate|CS-0205912
      2069-36-5

    References

    • Forbes et al. Journal of the Chemical Society, 1959 , p. 2019

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

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Computational Chemistry Data

  • TPSA   43.37
  • LogP   3.45822
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   3

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