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CS-W001157 4
Total: USD 88.00

Diethyl 2-(2,2,2-trifluoroacetyl)succinate

  • CAS No. 94633-25-7

  • Cat. No. CS-0467347
  • Purity≥98%
  • MDL No.MFCD07779768

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

Diethyl 2-(2,2,2-trifluoroacetyl)succinate|CS-0467347

Structure of 94633-25-7

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General Information

  • CAS No. 94633-25-7
  • Cat. No. CS-0467347
  • Purity ≥98%
  • MDL No. MFCD07779768
  • Storage Store at room temperature, keep dry and cool
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₃F₃O₅
  • Molecular Weight 270.20
  • Synonym(s) None
  • SMILES CCOC(=O)CC(C(=O)C(F)(F)F)C(=O)OCC

Synthesis

  • Route1

    References

    • NOVARTIS AG Patent: WO2008/74752 A2, 2008 ; Location in patent: Page/Page column 33 ; WO 2008/074752 A2
  • Route2
    • null|null
      105-36-2
    • null|null
      372-31-6
    • ~53%
    • Diethyl 2-(2,2,2-trifluoroacetyl)succinate|CS-0467347
      94633-25-7

    References

    • PONIARD PHARMACEUTICALS, INC. Patent: WO2009/139834 A1, 2009 ; Location in patent: Page/Page column 164 ;
  • Route3
    • null|null
      105-39-5
    • null|null
      372-31-6
    • ~79%
    • Diethyl 2-(2,2,2-trifluoroacetyl)succinate|CS-0467347
      94633-25-7

    References

    • Blobaum, Anna L.; Uddin, Md. Jashim; Felts, Andrew S.; Crews, Brenda C.; Rouzer, Carol A.; Marnett, Lawrence J. ACS Medicinal Chemistry Letters, 2013 , vol. 4, # 5 p. 486 - 490

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   69.67
  • LogP   1.2503
  • H_Acceptors   5
  • H_Donors   0
  • Rotatable_Bonds   6

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