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CS-W001157 4
Total: USD 88.00

2,3,5,6-Tetrafluoro-4-mercapto-benzoic acid

  • CAS No. 5211-44-9

  • Cat. No. CS-0170373
  • Purity≥98%
  • MDL No.MFCD00129954

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

2,3,5,6-Tetrafluoro-4-mercapto-benzoic acid|CS-0170373

Structure of 5211-44-9

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General Information

  • CAS No. 5211-44-9
  • Cat. No. CS-0170373
  • Purity ≥98%
  • MDL No. MFCD00129954
  • Storage RT, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₂F₄O₂S
  • Molecular Weight 226.14
  • Synonym(s) None
  • SMILES O=C(O)C1=C(F)C(F)=C(S)C(F)=C1F

Synthesis

  • Route1

    References

    • Tamborski, C.; Soloski, E. J. Journal of Organic Chemistry, 1966 , vol. 31, p. 743 - 745
  • Route2

    References

    • Fielding, H. C.; Shirley, I. M. Journal of Fluorine Chemistry, 1992 , vol. 59, # 1 p. 15 - 31
  • Route3
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      363-72-4
    • ~%
    • 2,3,5,6-Tetrafluoro-4-mercapto-benzoic acid|CS-0170373
      5211-44-9

    References

    • Gmelin Handbook: F: PerFHalOrg.1, 1.1.6.2, page 97 - 116

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319
Precautionary Statements : P264-P280-P302+P352-P362+P364

Quality Control

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Computational Chemistry Data

  • TPSA   37.3
  • LogP   2.2299
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   1

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