chempirical

Disodium malonate

C3H2Na2O4CAS 141-95-7148.02 g/mol

Open in Covalent MOL file
O−OO−ONa+Na+
Carboxylic acid

Properties

Molecular formula
C3H2Na2O4
Molar mass
148.02 g/mol
Exact mass
147.9748 Da
Density
2.08 g/mL
logP
-1.22Crippen estimate
Polar surface area
74.6 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
2

Identifiers

CAS number
141-95-7
SMILES
[O-]C(=O)CC([O-])=O.[Na+].[Na+]
InChIKey
SXJCWCGNPYHALZ-UHFFFAOYSA-N
InChI
InChI=1S/C3H4O4.2Na/c4-2(5)1-3(6)7;;/h1H2,(H,4,5)(H,6,7);;

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

Names and synonyms

4 names
  • Propanedioic acid, sodium salt (1:2)
  • Malonic acid, disodium salt
  • Propanedioic acid, disodium salt
  • Sodium malonate

Work with Disodium malonate

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

Disodium succinate150-90-367 % similar Thallous malonate2757-18-867 % similar Sodium bromoacetate1068-52-657 % similar Sodium propionate137-40-657 % similar Disodium sebacate17265-14-457 % similar Sodium glycolate2836-32-057 % similar Sodium iodoacetate305-53-357 % similar Sodium thioglycolate367-51-157 % similar

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

Elsewhere

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