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CS-W001157 4
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Ethyl 3-oxo-3-(pyridin-2-yl)propanoate

  • CAS No. 26510-52-1

  • Cat. No. CS-W004737
  • Purity≥95%
  • MDL No.MFCD00094022

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

Ethyl 3-oxo-3-(pyridin-2-yl)propanoate|CS-W004737

Structure of 26510-52-1

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General Information

  • CAS No. 26510-52-1
  • Cat. No. CS-W004737
  • Purity ≥95%
  • MDL No. MFCD00094022
  • Storage RT, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₁NO₃
  • Molecular Weight None
  • Synonym(s) ethyl 3-oxo-3-(2-pyridyl)propanoate
  • SMILES O=C(OCC)CC(C1=NC=CC=C1)=O

Description

Ethyl 3-oxo-3-(pyridin-2-yl)propanoate features a pyridin-2-yl group that enhances regioselectivity in aldol-type condensations. The β-ketoester moiety enables facile enolization and efficient coupling with nucleophiles under mild conditions. This compound serves as a key scaffold for heterocyclic synthesis, particularly in constructing fused pyridine systems via intramolecular cyclization.

Application

Ethyl 3-oxo-3-(pyridin-2-yl)propanoate serves as a versatile building block in heterocyclic synthesis, enabling efficient access to pyridine-fused scaffolds via condensation and cyclization reactions. Its α,β-unsaturated ketone functionality facilitates Michael additions and aldol-type transformations, while the ester group supports selective derivatization. Bench-stable and readily purified by column chromatography, it functions reliably in multi-step sequences for medicinal chemistry and process development.

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   56.26
  • LogP   1.2175
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   4

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