Diethyl oxomalonate

Diethyl oxomalonate
Names
Preferred IUPAC name
Diethyl oxopropanedioate
Other names
Diethyl mesoxalate; Ethyl ketomalonate; Diethyl ketomalonate
Identifiers
3D model (JSmol)
ChemSpider
ECHA InfoCard 100.009.252
EC Number
  • 210-176-2
UNII
  • InChI=1S/C7H10O5/c1-3-11-6(9)5(8)7(10)12-4-2/h3-4H2,1-2H3
    Key: DBKKFIIYQGGHJO-UHFFFAOYSA-N
  • CCOC(=O)C(=O)C(=O)OCC
Properties
C7H10O5
Molar mass 174.152 g·mol−1
Appearance Clear colorless to yellow liquid
Density 1.142 g/cm3
Melting point −30 °C (−22 °F; 243 K)
Boiling point 208–210 °C (406–410 °F; 481–483 K)
96–97 °C (12 mmHg)
Highly soluble
Solubility in ethanol, diethylether, chloroform Soluble
Hazards
GHS labelling:[1]
Warning
H315, H319, H335
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
Except where otherwise noted, data are given for materials in their standard state (at 25 °C [77 °F], 100 kPa).
Infobox references

Diethyl oxomalonate is the diethyl ester of mesoxalic acid (ketomalonic acid), the simplest oxodicarboxylic acid and thus the first member (n = 0) of a homologous series HOOC–CO–(CH2)n–COOH with the higher homologues oxalacetic acid (n = 1), α-ketoglutaric acid (n = 2) and α-ketoadipic acid (n = 3) (the latter a metabolite of the amino acid lysine). Diethyl oxomalonate reacts because of its highly polarized keto group as electrophile in addition reactions and is a highly active reactant in pericyclic reactions such as the Diels-Alder reactions, cycloadditions or ene reactions. At humid air, mesoxalic acid diethyl ester reacts with water to give diethyl mesoxalate hydrate and the green-yellow oil are spontaneously converted to white crystals.