Methyl 4-oxobutanoate
Properties
- Molecular formula
- C5H8O3
- Molar mass
- 116.12 g/mol
- Exact mass
- 116.0473 Da
- Boiling point
- 62 °C (at 10 Torr)
- logP
- 0.14Crippen estimate
- Polar surface area
- 43.4 Ų
- H-bond donors / acceptors
- 0 / 3
- Rotatable bonds
- 3
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation50% of notifiers
Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
13865-19-5SMILES
COC(=O)CCC=OInChIKey
DLZVZNAPRCRXEG-UHFFFAOYSA-NInChI
InChI=1S/C5H8O3/c1-8-5(7)3-2-4-6/h4H,2-3H2,1H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
15 names · show all
- Butanoic acid, 4-oxo-, methyl ester
- Succinaldehydic acid, methyl ester
- Methyl β-formylpropionate
- 3-(Methoxycarbonyl)propionaldehyde
- Methyl 3-formylpropionate
- β-(Methoxycarbonyl)propionaldehyde
- Methyl 4-oxobutyrate
- 3-Carbomethoxypropionaldehyde
- β-Carbomethoxypropionaldehyde
- 3-Formylpropionic acid methyl ester
- Methoxycarbonylpropanal
- 3-(Methoxycarbonyl)propanal
- 4-Oxobutanoic acid methyl ester
- Methyl 3-formylpropanoate
- 4-Oxobutyric acid methyl ester
Work with Methyl 4-oxobutanoate
Similar compounds
Dimethyl succinate106-65-061 % similar
Dimethyl glutarate1119-40-058 % similar
Dimethyladipate627-93-056 % similar
Dimethyl sebacate106-79-654 % similar
Dimethyl octadecanedioate1472-93-154 % similar
1,12-Dimethyl dodecanedioate1731-79-954 % similar
Dimethyl pimelate1732-08-754 % similar
Dimethyl suberate1732-09-854 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.