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CS-W001157 4
Total: USD 88.00

Ethyl 3-oxo-3-(4-(trifluoromethyl)phenyl)propanoate

  • CAS No. 106263-53-0

  • Cat. No. CS-W010149
  • Purity≥96%
  • MDL No.MFCD03424818

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

Ethyl 3-oxo-3-(4-(trifluoromethyl)phenyl)propanoate|CS-W010149

Structure of 106263-53-0

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General Information

  • CAS No. 106263-53-0
  • Cat. No. CS-W010149
  • Purity ≥96%
  • MDL No. MFCD03424818
  • Storage RT, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₁F₃O₃
  • Molecular Weight None
  • Synonym(s) 3-Oxo-3-(4-trifluoromethylphenyl)propanoic acid ethyl ester
  • SMILES CCOC(=O)CC(=O)C1=CC=C(C=C1)C(F)(F)F

Synthesis

  • Route1
    • Ethyl 3-hydroxy-3-(4-(trifluoromethyl)phenyl)propanoate|CS-0750108
      1274019-46-3
    • ~72%
    • In-stock
      Ethyl 3-oxo-3-(4-(trifluoromethyl)phenyl)propanoate|CS-W010149
      106263-53-0

    References

    • Chemistry - An Asian Journal, , vol. 6, # 8 p. 2073 - 2079
  • Route2
    • In-stock
      1-(4-(Trifluoromethyl)phenyl)ethanone|CS-W007473
      709-63-7
    • null|null
      105-58-8
    • ~%
    • In-stock
      Ethyl 3-oxo-3-(4-(trifluoromethyl)phenyl)propanoate|CS-W010149
      106263-53-0

    References

    • EP1340749 A1, ;
  • Route3
    • null|null
      623-73-4
    • In-stock
      1-Formyl-4-trifluoromethylbenzene|CS-W008968
      455-19-6
    • ~59%
    • In-stock
      Ethyl 3-oxo-3-(4-(trifluoromethyl)phenyl)propanoate|CS-W010149
      106263-53-0

    References

    • Journal of Medicinal Chemistry, , vol. 55, # 5 p. 1831 - 1843

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   43.37
  • LogP   2.8413
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   4

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