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ethyl isonicotinoylacetate
Weight193.202 g/mol
FormulaC10H11NO3
Hydrogen Acceptors4
Hydrogen Donors0
Aromatic Rings1
Rotatable Bonds4

ethyl isonicotinoylacetate (26377-17-3)

26377-17-3  ·  ethyl 3-oxo-3-pyridin-4-ylpropanoate

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Alternate Names

  • 26377-17-3
  • ethyl 3-oxo-3-pyridin-4-ylpropanoate
  • SMILES
    CCOC(=O)CC(=O)C1=CC=NC=C1
  • InChIKey
    PCJNYGPKMQQCPX-UHFFFAOYSA-N

Estimated Properties

Boiling Point 284.12 C EPA T.E.S.T.
Boiling Point 291.6 C EPI Suite
Density 1.13 g/cm3 EPA T.E.S.T.
Flash Point 123.96 C EPA T.E.S.T.
Melting Point 77.57 C EPI Suite
Water Solubility 3980.04 mg/L EPA T.E.S.T.
Water Solubility 573030 mg/L EPI Suite

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Synthesis

Pyridine  +  36239-09-5 (Friedel-Crafts acylation)
ETHYL CYANOACETATE  +  4-CHLOROPYRIDINE (Grignard carbonyl)
3-OXO-3-(PYRIDIN-4-YL)PROPANOIC ACID  +  Chloroethane (Ester from carboxilic acid(SN2))
Reactant  +  dimethyl sulfide (Corey-Kim oxidation of secondary alcohols)
Reactant  +  Ethanol (O-acylation)
Synthesis of ethyl isonicotinoylacetate ›

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