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Ethyl 5-methyl-2-(trifluoromethyl)furan-3-carboxylate

  • CAS No. 17515-73-0

  • Cat. No. CS-0061544
  • Molecule weight222.16
  • Purity≥95%
  • MDL No.MFCD00275564

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

Ethyl 5-methyl-2-(trifluoromethyl)furan-3-carboxylate|CS-0061544

Structure of 17515-73-0

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General Information

  • CAS No. 17515-73-0
  • Cat. No. CS-0061544
  • Purity ≥95%
  • MDL No. MFCD00275564
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₉F₃O₃
  • Molecular Weight 222.16
  • Synonym(s) ETHYL 5-METHYL-2-(TRIFLUOROMETHYL)-3-FUROATE
  • SMILES CCOC(=O)C1=C(C(F)(F)F)OC(=C1)C

Synthesis

  • Route1
    • Ethyl 4-oxo-2-(2,2,2-trifluoroacetyl)pentanoate|CS-0627630
      17515-66-1
    • ~72%
    • In-stock
      Ethyl 5-methyl-2-(trifluoromethyl)furan-3-carboxylate|CS-0061544
      17515-73-0

    References

    • Takeda Chemical Industries, Ltd. Patent: EP1362846 A1, 2003 ; Location in patent: Page/Page column 125 ; EP 1362846 A1

Safety Information

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Quality Control

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Computational Chemistry Data

  • TPSA   39.44
  • LogP   2.78352
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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