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CS-W001157 4
Total: USD 88.00

1-(4-Aminophenyl)-2,2,2-trifluoro-1-ethanone

  • CAS No. 23516-79-2

  • Cat. No. CS-W000381
  • Purity≥97%
  • MDL No.MFCD05663790

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

1-(4-Aminophenyl)-2,2,2-trifluoro-1-ethanone|CS-W000381

Structure of 23516-79-2

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General Information

  • CAS No. 23516-79-2
  • Cat. No. CS-W000381
  • Purity ≥97%
  • MDL No. MFCD05663790
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₆F₃NO
  • Molecular Weight 189.13
  • Synonym(s) 1-(4-Aminophenyl)-2,2,2-trifluoroethan-1-one
  • SMILES O=C(C(F)(F)F)c1ccc(cc1)N

Description

1-(4-Aminophenyl)-2,2,2-trifluoro-1-ethanone features a para-aminophenyl group conjugated to a trifluoromethyl ketone, delivering enhanced electrophilicity and solubility in polar organic solvents. This scaffold enables direct incorporation into bioconjugation workflows and modular synthesis of fluorinated aryl amides.

Application

1-(4-Aminophenyl)-2,2,2-trifluoro-1-ethanone serves as a versatile building block for the synthesis of fluorinated aromatic amides and heterocyclic scaffolds. Its trifluoromethyl ketone functionality enables efficient imine formation, reductive amination, and coupling reactions with amines and hydrazines. The molecule exhibits good bench stability and facilitates straightforward purification, making it well-suited for medicinal chemistry campaigns requiring fluorinated aryl amide motifs.

Synthesis

  • Route1

    References

    • Mertz, Eric; Zimmerman, Steven C. Journal of the American Chemical Society, 2003 , vol. 125, # 12 p. 3424 - 3425
  • Route2
    • null|null
      144459-68-7
    • ~77%
    • In-stock
      1-(4-Aminophenyl)-2,2,2-trifluoro-1-ethanone|CS-W000381
      23516-79-2

    References

    • Wallace, David M.; Haramura, Masayuki; Cheng, Jie-Fei; Arrhenius, Thomas; Nadzan, Alex M. Bioorganic and Medicinal Chemistry Letters, 2007 , vol. 17, # 4 p. 1127 - 1130
  • Route3
    • null|null
      460-00-4
    • ~%
    • In-stock
      1-(4-Aminophenyl)-2,2,2-trifluoro-1-ethanone|CS-W000381
      23516-79-2

    References

    • Journal of the American Chemical Society, , vol. 125, # 12 p. 3424 - 3425

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   43.09
  • LogP   2.0138
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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