ChemicalBook Product Catalog Pharmaceutical intermediates Bulk Drug Intermediates 2-Cyanoethyl 3-oxobutanoate

2-Cyanoethyl 3-oxobutanoate

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
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
2-Cyanoethyl 3-oxobutanoate Structure
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
pka10.04±0.46(Predicted)
Safety Information
MSDS Information
2-Cyanoethyl 3-oxobutanoate Usage And Synthesis
Chemical PropertiesYellow to brown liquid.
Uses2-Cyanoethyl Acetoacetate is an intermediate in the synthesis of Felodipine-d3 (F232377), a labelled dihydropyridine calcium channel blocker.
Application2-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.
2-Cyanoethyl 3-oxobutanoate Preparation Products And Raw materials
Raw materials3-Hydroxypropionitrile-->Acetyl ketene-->Methyl acetoacetate-->2,2,6-Trimethyl-4H-1,3-dioxin-4-one
Preparation Products2-cyanoethyl (2Z)-2-[(3-nitrophenyl)methylidene]-3-oxobutanoate
Ethyl 3-oxo-4-phenylbutanoate Sodium cyanoborohydride
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