Tetrasodium ethylenediaminetetraacetate dihydrate

C₁₀H₁₆N₂Na₄O₁₀CAS 10378-23-1416.20 g/mol

Open in Covalent MOL file

Carboxylic acid Tertiary amine

Properties

Molecular formula: C₁₀H₁₆N₂Na₄O₁₀
Molar mass: 416.20 g/mol
Exact mass: 416.0396 Da
logP: -5.24Crippen estimate
Polar surface area: 218.7 Å²
H-bond donors / acceptors: 4 / 6
Rotatable bonds: 11

Identifiers

CAS number

10378-23-1

SMILES

[O-]C(=O)CN(CCN(CC([O-])=O)CC([O-])=O)CC([O-])=O.O.O.[Na+].[Na+].[Na+].[Na+]

InChIKey

DGWOWDJDIBPYOR-UHFFFAOYSA-N

InChI

InChI=1S/C10H16N2O8.4Na.2H2O/c13-7(14)3-11(4-8(15)16)1-2-12(5-9(17)18)6-10(19)20;;;;;;/h1-6H2,(H,13,14)(H,15,16)(H,17,18)(H,19,20);;;;;2*1H2

Weigh it out

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

Names and synonyms

3 names

Glycine, N,N′-1,2-ethanediylbis[N-(carboxymethyl)-, sodium salt, hydrate (1:4:2)
Acetic acid, (ethylenedinitrilo)tetra-, tetrasodium salt, dihydrate
Glycine, N,N′-1,2-ethanediylbis[N-(carboxymethyl)-, tetrasodium salt, dihydrate

Work with Tetrasodium ethylenediaminetetraacetate dihydrate

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

Ethylenediaminetetraacetic acid tetrasodium salt tetrahydrate13235-36-4100 % similar Glycine, N,N′-1,2-ethanediylbis[N-(carboxymethyl)-, tetrasodium salt, trihydrate67401-50-7100 % similar Calciate(2-), [[N,N′-1,2-ethanediylbis[N-[(carboxy-κO)methyl]glycinato-κN,κO]](4-)]-, sodium, hydrate (1:2:?), (oc-6-21)-23411-34-988 % similar Tetrasodium edta64-02-887 % similar Pentasodium pentetate140-01-283 % similar Trisodium nitrilotriacetate monohydrate18662-53-883 % similar Copper disodium edta14025-15-177 % similar Disodium zinc edta14025-21-977 % similar

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

Elsewhere

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