Edetate calcium disodium anhydrous

C₁₀H₁₂CaN₂Na₂O₈CAS 62-33-9374.27 g/mol

Open in Covalent MOL file

Carboxylic acid Tertiary amine

Properties

Molecular formula: C₁₀H₁₂CaN₂Na₂O₈
Molar mass: 374.27 g/mol
Exact mass: 374.0015 Da
logP: -13.78Crippen estimate
Polar surface area: 167.0 Å²
H-bond donors / acceptors: 0 / 10
Rotatable bonds: 11

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

62-33-9

SMILES

O=C([O-])CN(CCN(CC(=O)[O-])CC(=O)[O-])CC(=O)[O-].[Ca+2].[Na+].[Na+]

InChIKey

SHWNNYZBHZIQQV-UHFFFAOYSA-J

InChI

InChI=1S/C10H16N2O8.Ca.2Na/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;+2;2*+1/p-4

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

Names and synonyms

54 names · show all

Calcium disodium edta
Calciate(2-), [[N,N′-1,2-ethanediylbis[N-[(carboxy-κO)methyl]glycinato-κN,κO]](4-)]-, sodium (1:2), (OC-6-21)-
Calciate(2-), [(ethylenedinitrilo)tetraacetato]-, disodium
Calciate(2-), [[N,N′-1,2-ethanediylbis[N-(carboxymethyl)glycinato]](4-)-N,N′,O,O′,ON,ON′]-, disodium, (OC-6-21)-
Disodium [(ethylenedinitrilo)tetraacetato]calciate
Calciate(2-), [[N,N′-1,2-ethanediylbis[N-[(carboxy-κO)methyl]glycinato-κN,κO]](4-)]-, disodium, (OC-6-21)-
Calcium disodium ethylenediaminetetraacetate
Edathamil calcium disodium
Sodium calcium edetate
Calcium disodium Versenate
Calcium EDTA
Disodium calcium EDTA
Disodium calcium ethylenediaminetetraacetate
EDTA calcium disodium salt
Edetamin
Calcium sodium edetate
Calcium disodium edetate
Calcium sodium EDTA
Calcium disodium edathamil
Edetate calcium
Monocalcium disodium EDTA
Tetacin-calcium
Ethylenediaminetetraacetic acid calcium disodium salt
(Ethylenedinitrilo)tetraacetic acid calcium disodium salt
Calcitetracemate disodium
Calcium disodium (ethylenedinitrilo)tetraacetate
Edetic acid calcium disodium salt
Mosatil
Antallin
Sormetal
EDTA disodium calcium salt
Ethylenediaminetetraacetic acid calcium sodium salt (1:1:2)
Edtacal
Tetazine
Tetacin
Glycine, N,N′-1,2-ethanediylbis[N-(carboxymethyl)-, calcium sodium salt (1:1:2)
Disodium monocalcium EDTA
Adsorbonac
Calcium titriplex
Edetamine
Ledclair
Versene CA
Ethylenediaminetetraacetic acid disodium monocalcium salt
Calcium disodium ethylenediaminetetraacetic acid
EDTA calcium
Edathamiol calcium disodium
Edetate calcium disodium
NSC 310151
Disodium calcium edetate
Detoxamin
EDTA disodium calcium
Calcium EDTA disodium salt
Disodium EDTA calcium
EDTA-Ca

Work with Edetate calcium disodium anhydrous

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Calciate(2-), [[N,N′-1,2-ethanediylbis[N-[(carboxy-κO)methyl]glycinato-κN,κO]](4-)]-, sodium, hydrate (1:2:?), (OC-6-21)-23411-34-9Hydrate Ethylenediaminetetraacetic acid60-00-4Free acid Disodium ethylenediaminetetraacetate139-33-3Salt Tetrasodium EDTA64-02-8Salt Ferric sodium EDTA15708-41-5Salt Trisodium EDTA150-38-9Salt Disodium zinc EDTA14025-21-9Salt Disodium zinc EDTA39208-16-7Salt Copper disodium EDTA14025-15-1Salt Magnesium disodium EDTA14402-88-1Salt Disodium manganese EDTA15375-84-5Salt Dipotassium EDTA2001-94-7Salt

Similar compounds

Pentasodium pentetate140-01-283 % similar Trisodium nitrilotriacetate5064-31-371 % similar Trisodium HEDTA139-89-967 % similar Trisodium nitrilotriacetate monohydrate18662-53-863 % similar N-(2-Acetamido)iminodiacetic acid disodium salt41689-31-057 % similar Disodium nitrilotriacetate15467-20-655 % similar Gd-DTPA80529-93-752 % similar Gadoteric acid72573-82-148 % similar

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

Elsewhere

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