chempirical

Trisodium nitrilotriacetate

C6H6NNa3O6CAS 5064-31-3257.08 g/mol

Open in Covalent MOL file
O−ONO−OO−ONa+Na+Na+
Carboxylic acidTertiary amine

Properties

Molecular formula
C6H6NNa3O6
Molar mass
257.08 g/mol
Exact mass
256.9888 Da
logP
-2.60Crippen estimate
Polar surface area
115.1 Ų
H-bond donors / acceptors
3 / 4
Rotatable bonds
6

Identifiers

CAS number
5064-31-3
SMILES
[O-]C(=O)CN(CC([O-])=O)CC([O-])=O.[Na+].[Na+].[Na+]
InChIKey
WHXMQMILJXVLKE-UHFFFAOYSA-N
InChI
InChI=1S/C6H9NO6.3Na/c8-4(9)1-7(2-5(10)11)3-6(12)13;;;/h1-3H2,(H,8,9)(H,10,11)(H,12,13);;;

Weigh it out

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

Names and synonyms

29 names · show all
  • Glycine, N,N-bis(carboxymethyl)-, sodium salt (1:3)
  • Acetic acid, nitrilotri-, trisodium salt
  • Glycine, N,N-bis(carboxymethyl)-, trisodium salt
  • Nitrilotriacetic acid trisodium salt
  • Trilon A
  • Chemcolox 365 powder
  • Hampshire NTA 150
  • Versene NTA 150
  • Versene NTA 335
  • Syntron A
  • Masquol NP 140
  • NTA trisodium salt
  • Trilon A 50
  • Trilon A 92
  • NTA sodium salt
  • Trisodium NTA
  • Trisodium 2,2′,2′′-nitrilotriacetate
  • Clewat C 3
  • Trilon A 92R
  • Dissolvine A 40
  • Versene NTA 148
  • A 92R
  • Chelest 70
  • Chelest 700
  • Dissolvine A 92
  • Chelest 3NTA
  • Danfix 309
  • LH 700
  • Clewat PC-C 3

Work with Trisodium nitrilotriacetate

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

Trisodium nitrilotriacetate monohydrate18662-53-886 % similar Tetrasodium edta64-02-881 % similar Pentasodium pentetate140-01-277 % similar Disodium nitrilotriacetate15467-20-672 % similar Tetrasodium ethylenediaminetetraacetate dihydrate10378-23-171 % similar Ethylenediaminetetraacetic acid tetrasodium salt tetrahydrate13235-36-471 % similar Copper disodium edta14025-15-171 % similar Disodium zinc edta14025-21-971 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook