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CS-W001157 4
Total: USD 88.00

2,2,2-Trifluoro-N-(4-mercaptophenyl)acetamide

  • CAS No. 94006-35-6

  • Cat. No. CS-0093632
  • Molecule weight221.20
  • Purity≥98%
  • MDL No.None

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

2,2,2-Trifluoro-N-(4-mercaptophenyl)acetamide|CS-0093632

Structure of 94006-35-6

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General Information

  • CAS No. 94006-35-6
  • Cat. No. CS-0093632
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₆F₃NOS
  • Molecular Weight 221.20
  • Synonym(s) N-trifluoroacetyl-p-mercaptoaniline
  • SMILES O=C(NC1=CC=C(S)C=C1)C(F)(F)F

Synthesis

  • Route1
    • null|null
      131042-42-7
    • ~73%
    • 2,2,2-Trifluoro-N-(4-mercaptophenyl)acetamide|CS-0093632
      94006-35-6

    References

    • Sengar, Raghvendra S.; Nemykin, Victor N.; Basu, Partha New Journal of Chemistry, 2003 , vol. 27, # 7 p. 1115 - 1123
  • Route2
    • null|null
      722-27-0
    • ~%
    • 2,2,2-Trifluoro-N-(4-mercaptophenyl)acetamide|CS-0093632
      94006-35-6

    References

    • Sengar, Raghvendra S.; Nemykin, Victor N.; Basu, Partha New Journal of Chemistry, 2003 , vol. 27, # 7 p. 1115 - 1123
  • Route3

    References

    • Tretyakov, Kirill V.; Todua, Nino G.; Borisov, Roman S.; Zaikin, Vladimir G.; Stein, Stephen E.; Mikaia, Anzor I. Rapid Communications in Mass Spectrometry, 2010 , vol. 24, # 17 p. 2529 - 2532

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   29.1
  • LogP   2.4761
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   1

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