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CS-W001157 4
Total: USD 88.00

3-(4-(Trifluoromethyl)phenyl)propanoic acid

  • CAS No. 53473-36-2

  • Cat. No. CS-M0217
  • Purity≥95%
  • MDL No.None

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

3-(4-(Trifluoromethyl)phenyl)propanoic acid|CS-M0217

Structure of 53473-36-2

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General Information

  • CAS No. 53473-36-2
  • Cat. No. CS-M0217
  • Purity ≥95%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₉F₃O₂
  • Molecular Weight 218.17
  • Synonym(s) 7-amino-4-(trifluoromethyl)-2H-chromen-2-one
  • SMILES O=C(O)CCC1=CC=C(C=C1)C(F)(F)F

Description

This trifluoromethyl-substituted phenylpropanoic acid features a robust electron-deficient aryl group that enhances metabolic stability and lipophilicity. The carboxylic acid functionality enables direct coupling in peptide synthesis or conjugation workflows, while the para-trifluoromethyl moiety imparts high chemical resilience under standard reaction conditions.

Synthesis

  • Route1

    References

    • Quinn, John F.; Razzano, Dana A.; Golden, Kathryn C.; Gregg, Brian T. Tetrahedron Letters, 2008 , vol. 49, # 42 p. 6137 - 6140
  • Route2

    References

    • ACTELION PHARMACEUTICALS LTD; ERBECK, Silke; KOBERSTEIN, Ralf; SOI, Antonio; ZISTLER, Andrea Patent: WO2010/64212 A1, 2010 ; Location in patent: Page/Page column 23 ;
  • Route3
    • null|null
      3984-22-3
    • In-stock
      1-Bromo-4-(trifluoromethyl)benzene|CS-W014220
      402-43-7
    • ~94%
    • In-stock
      3-(4-(Trifluoromethyl)phenyl)propanoic acid|CS-M0217
      53473-36-2

    References

    • Lemhadri, Mhamed; Doucet, Henri; Santelli, Maurice Tetrahedron, 2004 , vol. 60, # 50 p. 11533 - 11540

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-P405-P501

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Computational Chemistry Data

  • TPSA   37.3
  • LogP   2.7226
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   3

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