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3-(3-(Trifluoromethoxy)phenyl)propanoic acid

  • CAS No. 168833-77-0

  • Cat. No. CS-0084803
  • Molecule weight234.17
  • Purity98+%
  • MDL No.MFCD01317834

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

3-(3-(Trifluoromethoxy)phenyl)propanoic acid|CS-0084803

Structure of 168833-77-0

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General Information

  • CAS No. 168833-77-0
  • Cat. No. CS-0084803
  • Purity 98+%
  • MDL No. MFCD01317834
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₉F₃O₃
  • Molecular Weight 234.17
  • Synonym(s) 3-[3-(trifluoromethoxy)phenyl]propanoic acid
  • SMILES O=C(O)CCC1=CC=CC(OC(F)(F)F)=C1

Synthesis

  • Route1

    References

    • US5567734 A1, ;
  • Route2

    References

    • WO2005/123681 A1, ; Page/Page column 33 ;

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-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   46.53
  • LogP   2.6024
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   4

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