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CS-W001157 4
Total: USD 88.00

4-Hydroxydihydrofuran-2(3H)-one Empagliflozin Impurity

  • CAS No. 5469-16-9

  • Cat. No. CS-0228963
  • Purity≥98%
  • MDL No.MFCD00090014

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

4-Hydroxydihydrofuran-2(3H)-one Empagliflozin Impurity|CS-0228963

Structure of 5469-16-9

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General Information

  • CAS No. 5469-16-9
  • Cat. No. CS-0228963
  • Purity ≥98%
  • MDL No. MFCD00090014
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₄H₆O₃
  • Molecular Weight 102.09
  • Synonym(s) 2(3H)-Furanone, dihydro-4-hydroxy-
  • SMILES O=C1OCC(O)C1

Synthesis

  • Route1
    • (2R,3R,4R,5S,6R)-6-(hydroxymethyl)-5-(((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2,3,4-triol|CS-0535815
      133-99-3
    • ~54%
    • 4-Hydroxydihydrofuran-2(3H)-one Empagliflozin Impurity|CS-0228963
      5469-16-9

    References

    • Council of Scientific and Industrial Research Patent: US6713639 B1, 2004 ; Location in patent: Page column 5-6 ;
  • Route2
    • (S)-4-chloro-3-hydroxybutanoic acid  Afatinib Impurity|CS-0164309
      106941-19-9
    • ~%
    • 4-Hydroxydihydrofuran-2(3H)-one Empagliflozin Impurity|CS-0228963
      5469-16-9

    References

    • WO2005/30747 A1, ; Page/Page column 5-6 ;
  • Route3

    References

    • Bode, Moira L.; Gates, Paul J.; Gebretnsae, Samson Y.; Vleggaar, Robert Tetrahedron, 2010 , vol. 66, # 11 p. 2026 - 2036

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05
Signal Word : Danger
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H318
Precautionary Statements : P280-P305+P351+P338

Quality Control

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Computational Chemistry Data

  • TPSA   46.53
  • LogP   -0.7058
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   0

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