chempirical

Disodium iminodiacetate

C4H5NNa2O4CAS 928-72-3177.07 g/mol

Open in Covalent MOL file
O−ONHO−ONa+Na+
Carboxylic acidSecondary amine

Properties

Molecular formula
C4H5NNa2O4
Molar mass
177.07 g/mol
Exact mass
177.0014 Da
logP
-2.02Crippen estimate
Polar surface area
86.6 Ų
H-bond donors / acceptors
3 / 3
Rotatable bonds
4

Identifiers

CAS number
928-72-3
SMILES
[O-]C(=O)CNCC([O-])=O.[Na+].[Na+]
InChIKey
CLZHLAZNAFPJGE-UHFFFAOYSA-N
InChI
InChI=1S/C4H7NO4.2Na/c6-3(7)1-5-2-4(8)9;;/h5H,1-2H2,(H,6,7)(H,8,9);;

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

Names and synonyms

7 names
  • Glycine, N-(carboxymethyl)-, sodium salt (1:2)
  • Acetic acid, iminodi-, disodium salt
  • Glycine, N-(carboxymethyl)-, disodium salt
  • Iminodiacetic acid sodium salt
  • Iminodiacetic acid disodium salt
  • IDA disodium salt
  • DSIDA

Work with Disodium iminodiacetate

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

Sodium (hydroxymethyl)glycinate70161-44-371 % similar Sodium sarcosinate4316-73-863 % similar Disodium malonate141-95-757 % similar Disodium succinate150-90-357 % similar Sodium bromoacetate1068-52-650 % similar Sodium propionate137-40-650 % similar Disodium sebacate17265-14-450 % similar Sodium glycolate2836-32-050 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook