CAS 67401-50-7|CAS 64-02-8|CAS 194491-31-1|EDTA tetrasodium salt|Tetrasodium ethylenediaminetetraacetate hydrate|tetrasodium 2-({2-[bis(carboxylatomethyl)amino]ethyl}(carboxylatomethyl)amino)acetate...

General Information

Structure

Molecular Formula

C₁₀H₁₂N₂Na₄O₈

Molecular Mass

380.16996

Exact Mass

380.01844248

Charge

InChI

InChI=1S/C10H16N2O8.4Na/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);;;;/q;4*+1/p-4

InChIKey

UEUXEKPTXMALOB-UHFFFAOYSA-J

Canonic Smiles

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

Isomeric Smiles

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

Calculated Properties

JChem

Acid pKa

1.486185

H Acceptors

H Donor

LogD (pH = 5.5)

-10.586659

LogD (pH = 7.4)

-14.721412

Log P

-5.221795

Molar Refractivity

105.694

Polarizability

24.221308

Polar Surface Area

167.0

Rotatable Bonds

Lipinski's Rule of Five

true

Data Source

Commercial Catalog

Academic Data

Data Source

Names and Identifiers

Synonyms

Tetrasodium ethylenediaminetetraacetate hydrateEDTA tetrasodium saltETHYLENEDIAMINE TETRAACETIC ACID TETRASODIUM SALT HYDRATEEdathamilVerseneEDTA tetrasodium乙二胺四乙酸四钠盐水合物Ethylenediaminetetraacetic acid tetrasodium salt hydrateEDTA tetrasodium salt hydrate

IUPAC name

tetrasodium 2-({2-[bis(carboxylatomethyl)amino]ethyl}(carboxylatomethyl)amino)acetate

IUPAC Traditional name

tetrapotassium ion(4-) edta tetrasodium ion(4-) edta

Names and Identifiers

Registration numbers

EC Number

200-573-9

CAS Number

67401-50-764-02-8194491-31-1

PubChem CID

6144