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CS-W001157 4
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Ethyl 3-cyclobutyl-3-oxopropanoate

  • CAS No. 24922-01-8

  • Cat. No. CS-0104189
  • Purity≥95%
  • MDL No.MFCD06410651

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

Ethyl 3-cyclobutyl-3-oxopropanoate|CS-0104189

Structure of 24922-01-8

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General Information

  • CAS No. 24922-01-8
  • Cat. No. CS-0104189
  • Purity ≥95%
  • MDL No. MFCD06410651
  • Storage RT, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₄O₃
  • Molecular Weight 170.21
  • Synonym(s) 3-CYCLOBUTYL-3-OXO-PROPIONIC ACID ETHYL ESTER
  • SMILES O=C(OCC)CC(C1CCC1)=O

Description

Ethyl 3-cyclobutyl-3-oxopropanoate features a cyclobutyl group flanking a β-keto ester motif, delivering enhanced stability and reactivity in synthetic transformations. This bench-stable compound integrates readily into complex molecular architectures, enabling efficient access to functionalized cyclobutane derivatives through controlled condensation and cyclization pathways.

Application

Ethyl 3-cyclobutyl-3-oxopropanoate serves as a versatile building block in synthetic organic chemistry, enabling efficient access to substituted cyclobutane derivatives. Its β-keto ester functionality facilitates aldol-type condensations, Michael additions, and cyclization reactions under mild conditions. The molecule exhibits good bench stability and simplifies purification due to its crystalline nature, making it well-suited for iterative synthesis and scale-up in medicinal chemistry and process development workflows.

Synthesis

  • Route1
    • In-stock
      3-Ethoxy-3-oxopropanoic acid potassium|CS-D1444
      6148-64-7
    • null|null
      5006-22-4
    • ~98%
    • In-stock
      Ethyl 3-cyclobutyl-3-oxopropanoate|CS-0104189
      24922-01-8

    References

    • WO2011/114148 A1, ; Page/Page column 81 ; WO 2011/114148 A1
  • Route2
    • In-stock
      3-Ethoxy-3-oxopropanoic acid|CS-0016016
      1071-46-1
    • null|null
      5006-22-4
    • ~79%
    • In-stock
      Ethyl 3-cyclobutyl-3-oxopropanoate|CS-0104189
      24922-01-8

    References

    • US2008/96921 A1, ; Page/Page column 45 ;
  • Route3
    • null|null
      855384-50-8
    • ~%
    • In-stock
      Ethyl 3-cyclobutyl-3-oxopropanoate|CS-0104189
      24922-01-8

    References

    • Journal of the American Chemical Society, , vol. 70, p. 497,499

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   1.3088
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   4

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