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CS-W001157 4
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Ethyl 4-methoxy-3-oxobutanoate

  • CAS No. 66762-68-3

  • Cat. No. CS-W022693
  • Purity≥97%
  • MDL No.MFCD07783018

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

Ethyl 4-methoxy-3-oxobutanoate|CS-W022693

Structure of 66762-68-3

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General Information

  • CAS No. 66762-68-3
  • Cat. No. CS-W022693
  • Purity ≥97%
  • MDL No. MFCD07783018
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₁₂O₄
  • Molecular Weight 160.17
  • Synonym(s) ETHYL 4-METHOXYACETOACETATE
  • SMILES CCOC(=O)CC(=O)COC

Description

Ethyl 4-methoxy-3-oxobutanoate features a strategically positioned methoxy group flanking a β-keto ester moiety, enabling efficient enolization and nucleophilic addition in C–C bond formation. This scaffold integrates readily into synthetic sequences requiring controlled reactivity under mild conditions.

Application

Ethyl 4-methoxy-3-oxobutanoate serves as a versatile synthon in carbonyl chemistry, enabling efficient access to substituted β-keto ester frameworks. Its methoxy-substituted enolizable α-carbon facilitates aldol-type condensations and Michael additions under mild conditions. The molecule exhibits bench stability and compatibility with common functional groups, simplifying purification and integration into multi-step synthetic sequences for heterocyclic and natural product synthesis.

Synthesis

  • Route1

    References

    • US2006/189664 A1, ; Page/Page column 8 ; US 20060189664 A1
  • Route2

    References

    • Journal of the American Chemical Society, , vol. 70, p. 500
  • Route3
    • null|null
      105-36-2
    • ~%
    • In-stock
      Ethyl 4-methoxy-3-oxobutanoate|CS-W022693
      66762-68-3

    References

    • Bulletin de la Societe Chimique de France, , vol. <4>29, p. 562

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

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Computational Chemistry Data

  • TPSA   52.6
  • LogP   0.1551
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   5

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