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2-Cyanoethyl 3-oxobutanoate

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2-Cyanoethyl 3-oxobutanoate Basic information

Product Name:
2-Cyanoethyl 3-oxobutanoate
Synonyms:
  • 2-Cyanoethylacetoacetate
  • Butanoic acid, 3-oxo-,2-cyanoethyl ester
  • 2-Cyanoethyl 3-Oxobutyrate
  • 3-Bromopropionaldehydedimethylacetal 65193-87-5
  • 6-cyano-3-oxohexanoate
  • 2-Cyaethyl Acetoacetate
CAS:
65193-87-5
MF:
C7H9NO3
MW:
155.15
EINECS:
613-755-1
Product Categories:
  • Intermediate
  • 65193-87-5
Mol File:
65193-87-5.mol
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2-Cyanoethyl 3-oxobutanoate Chemical Properties

Boiling point:
288.2±20.0 °C(Predicted)
Density 
1.123±0.06 g/cm3(Predicted)
storage temp. 
Sealed in dry,Store in freezer, under -20°C
pka
10.04±0.46(Predicted)
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2-Cyanoethyl 3-oxobutanoate Usage And Synthesis

Chemical Properties

Yellow to brown liquid.

Uses

2-Cyanoethyl Acetoacetate is an intermediate in the synthesis of Felodipine-d3 (F232377), a labelled dihydropyridine calcium channel blocker.

Application

2-Cyanoethyl 3-oxobutanoate is a diazepine that has been shown to have cardiac effects. It is used as a drug substance in the synthesis of diazepinone, which is a nitrosable drug and an infarction agent. It has been shown to induce cardiac contractility by binding to the functional site on the beta-1 adrenergic receptor. This compound also acts as an inhibitor of lipase, which may be due to its similarity in structure to the pharmacophore for this enzyme.

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