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CS-W001157 4
Total: USD 88.00

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

  • CAS No. 70311-33-0

  • Cat. No. CS-M0618
  • Purity≥95%
  • MDL No.MFCD07772964

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

Ethyl 3-(3-(trifluoromethyl)phenyl)propanoate|CS-M0618

Structure of 70311-33-0

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General Information

  • CAS No. 70311-33-0
  • Cat. No. CS-M0618
  • Purity ≥95%
  • MDL No. MFCD07772964
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₃F₃O₂
  • Molecular Weight 246.23
  • Synonym(s) ethyl 3-[3-(trifluoromethyl)phenyl]propanoate
  • SMILES O=C(OCC)CCC1=CC(C(F)(F)F)=CC=C1

Synthesis

  • Route1
    • Ethyl 3-(3-(trifluoromethyl)phenyl)acrylate|CS-0347971
      116577-12-9
    • ~%
    • Ethyl 3-(3-(trifluoromethyl)phenyl)propanoate|CS-M0618
      70311-33-0

    References

    • Brown; Blakemore; Durant; Emmett; Ganellin; Parsons; Rawlings; Walker European Journal of Medicinal Chemistry, 1988 , vol. 23, # 1 p. 53 - 62
  • Route2

    References

    • Amatore, Muriel; Gosmini, Corinne; Perichon, Jacques Journal of Organic Chemistry, 2006 , vol. 71, # 16 p. 6130 - 6134
  • Route3

    References

    • Battistuzzi, Gianfranco; Cacchi, Sandro; Fabrizi, Giancarlo; Bernini, Roberta Synlett, 2003 , # 8 p. 1133 - 1136

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-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   3.2011
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   4

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