Methyl acetopyruvate
Properties
- Molecular formula
- C6H8O4
- Molar mass
- 144.13 g/mol
- Exact mass
- 144.0423 Da
- Melting point
- 61.5–62.5 °C
- Boiling point
- 93–97 °C (at NaN Torr)
- logP
- -0.29Crippen estimate
- Polar surface area
- 60.4 Ų
- H-bond donors / acceptors
- 0 / 4
- Rotatable bonds
- 3
Hazards
Warning
- H319 Causes serious eye irritation100% of notifiers
Aggregated from 42 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P264+P265, P280, P305+P351+P338, P337+P317
Identifiers
CAS number
20577-61-1SMILES
COC(=O)C(=O)CC(C)=OInChIKey
OMHOEQINEXASKE-UHFFFAOYSA-NInChI
InChI=1S/C6H8O4/c1-4(7)3-5(8)6(9)10-2/h3H2,1-2H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
7 names
- Pentanoic acid, 2,4-dioxo-, methyl ester
- Valeric acid, 2,4-dioxo-, methyl ester
- Methyl β-acetylpyruvate
- Methyl 3-acetylpyruvate
- Methyl acetylpyruvate
- Methyl 2,4-dioxopentanoate
- 1-Methoxy-1,2,4-pentanetrione
Work with Methyl acetopyruvate
Similar compounds
Ethyl 2,4-dioxovalerate615-79-260 % similar
Methyl acetoacetate105-45-354 % similar
Methyl 3-bromopyruvate7425-63-052 % similar
Dimethyl 2-oxoglutarate13192-04-648 % similar
Acetylacetone123-54-646 % similar
Dimethyl oxalate553-90-246 % similar
Methyl pyruvate600-22-643 % similar
2,4-Dioxo-4-thiophen-2-yl-butyric acid methyl ester57409-51-543 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds