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CS-W001157 4
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1-(2-(Trifluoromethoxy)phenyl)ethan-1-one

  • CAS No. 220227-93-0

  • Cat. No. CS-0020116
  • Purity≥96%
  • MDL No.MFCD00236320

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

1-(2-(Trifluoromethoxy)phenyl)ethan-1-one|CS-0020116

Structure of 220227-93-0

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General Information

  • CAS No. 220227-93-0
  • Cat. No. CS-0020116
  • Purity ≥96%
  • MDL No. MFCD00236320
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₇F₃O₂
  • Molecular Weight 204.15
  • Synonym(s) 2-(trifluoromethoxy)acetophenone
  • SMILES CC(C1=CC=CC=C1OC(F)(F)F)=O

Description

1-(2-(Trifluoromethoxy)phenyl)ethan-1-one features a trifluoromethoxy-substituted phenyl ring linked to a ketone-bearing ethyl side chain. This electron-deficient aryl ketone exhibits enhanced solubility in organic solvents and stability under standard bench conditions, enabling efficient incorporation into synthetic pathways for pharmaceutical intermediates and functional materials.

Application

1-(2-(Trifluoromethoxy)phenyl)ethan-1-one serves as a versatile building block in medicinal chemistry, enabling efficient access to biologically relevant scaffolds. Its trifluoromethoxy-substituted aryl ketone functionality offers enhanced metabolic stability and modulated lipophilicity. The molecule facilitates standard transformations including nucleophilic additions, reductions, and coupling reactions, with good bench stability and straightforward purification, making it well-suited for iterative synthesis campaigns in drug discovery.

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H227-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   2.7878
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   2

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