chempirical

Meldrum'S acid

C6H8O4CAS 2033-24-1144.13 g/mol

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AcetalEsterLactone

Properties

Molecular formula
C6H8O4
Molar mass
144.13 g/mol
Exact mass
144.0423 Da
Melting point
94 °C
Boiling point
116–120 °C (at 14 Torr)
logP
0.21Crippen estimate
Polar surface area
52.6 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
0

Identifiers

CAS number
2033-24-1
SMILES
CC1(C)OC(=O)CC(=O)O1
InChIKey
GXHFUVWIGNLZSC-UHFFFAOYSA-N
InChI
InChI=1S/C6H8O4/c1-6(2)9-4(7)3-5(8)10-6/h3H2,1-2H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

13 names · show all
  • 1,3-Dioxane-4,6-dione, 2,2-dimethyl-
  • Malonic acid, cyclic isopropylidene ester
  • 2,2-Dimethyl-1,3-dioxane-4,6-dione
  • 2,2-Propanediol cyclic malonate
  • Cyclic isopropylidene malonate
  • 2,2-Dimethyl-m-dioxane-4,6-dione
  • Isopropylidene malonate
  • 2,2-Dimethyl-4,6-dioxo-1,3-dioxane
  • Meldrumic acid
  • 2,2-Dimethyl-1,3-dioxan-4,6-dione
  • NSC 688343
  • NSC 71902
  • N,N-Dimethyl-1-4-aminobilidine

Work with Meldrum'S acid

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

Similar compounds

1,3-Bis(1,1-dimethylethyl) propanedioate541-16-264 % similar 1-(1,1-Dimethylethyl) 3-methyl propanedioate42726-73-852 % similar 1-(1,1-Dimethylethyl) 3-ethyl propanedioate32864-38-348 % similar tert-Butyl acetoacetate1694-31-146 % similar 6,6-Dimethyl-5,7-dioxaspiro[2.5]octane-4,8-dione5617-70-946 % similar Mono-tert-butyl malonate40052-13-945 % similar Dimethyl malonate108-59-843 % similar tert-Butyl propionate20487-40-541 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

(±)-trans-1,2-Cyclobutanedicarboxylic acid1124-13-6 1,1-Cyclopropanedicarboxylic acid monomethyl ester113020-21-6 D-Lactide13076-17-0 Methyl β-acetylpyruvate20577-61-1 Monoethyl fumarate2459-05-4 2-Carboxyethyl acrylate24615-84-7 2-(2-Propen-1-yl)propanedioic acid2583-25-7 L-Lactide homopolymer33135-50-1

Elsewhere

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