chempirical

Ethyl 2-oxobutanoate

C6H10O3CAS 15933-07-0130.14 g/mol

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Properties

Molecular formula
C6H10O3
Molar mass
130.14 g/mol
Exact mass
130.0630 Da
Density
1.02 g/mL (at 20 °C)
Boiling point
140–145 °C (at 0.4 Torr)
logP
0.53Crippen estimate
Polar surface area
43.4 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
3

Identifiers

CAS number
15933-07-0
SMILES
CCOC(=O)C(=O)CC
InChIKey
FJAKCEHATXBFJT-UHFFFAOYSA-N
InChI
InChI=1S/C6H10O3/c1-3-5(7)6(8)9-4-2/h3-4H2,1-2H3

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Names and synonyms

10 names
  • Butanoic acid, 2-oxo-, ethyl ester
  • Butyric acid, 2-oxo-, ethyl ester
  • Ethyl 2-oxobutyrate
  • Ethyl α-oxobutyrate
  • Ethyl α-ketobutyrate
  • Ethyl 3-methylpyruvate
  • Ethyl 2-ketobutyrate
  • Ethyl α-oxobutanoate
  • 2-Oxobutanoic acid ethyl ester
  • 2-Oxobutyric acid ethyl ester

Work with Ethyl 2-oxobutanoate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Same formula

Ethyl 2-(hydroxymethyl)-2-propenoate10029-04-6 Ethyl (2S)-2-oxiraneacetate112083-63-3 Propionic anhydride123-62-6 3-(2-Propyn-1-yloxy)-1,2-propanediol13580-38-6 2-Hydroxyadipaldehyde141-31-1 Ethyl acetoacetate141-97-9 (±)-3-Methyl-2-oxovaleric acid1460-34-0 (4S)-2,2-Dimethyl-1,3-dioxolane-4-carboxaldehyde22323-80-4

Elsewhere

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