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CS-W001157 4
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2,2,2-Trifluoro-1-(4-(methylthio)phenyl)ethan-1-one

  • CAS No. 122243-33-8

  • Cat. No. CS-0303871
  • Purity≥97%
  • MDL No.None

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

2,2,2-Trifluoro-1-(4-(methylthio)phenyl)ethan-1-one|CS-0303871

Structure of 122243-33-8

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General Information

  • CAS No. 122243-33-8
  • Cat. No. CS-0303871
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₇F₃OS
  • Molecular Weight 220.21
  • Synonym(s) 2,2,2-Trifluoro-1-(4-methylsulfanylphenyl)ethanone
  • SMILES CSC1=CC=C(C=C1)C(=O)C(F)(F)F

Synthesis

  • Route1

    References

    • US6512020 B1, ;
  • Route2

    References

    • Findlay; Fishwick; Kersey; Ward Synthesis, 1995 , # 5 p. 553 - 556
  • Route3
    • null|null
      353-85-5
    • In-stock
      (4-Bromophenyl)(methyl)sulfane|CS-W015471
      104-95-0
    • ~%
    • In-stock
      2,2,2-Trifluoro-1-(4-(methylthio)phenyl)ethan-1-one|CS-0303871
      122243-33-8

    References

    • Journal of the American Chemical Society, , vol. 115, # 18 p. 8050 - 8059

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   17.07
  • LogP   3.1535
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   2

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