Edetate calcium disodiumProduct ingredient for Edetate calcium disodium anhydrous
- Name
- Edetate calcium disodium
- Drug Entry
- Edetate calcium disodium anhydrous
Edetate calcium disodium is a metal ion chelator used to reduce blood concentrations and depot stores of lead from the body.7 It is on the World Health Organization Model List of Essential Medicines.5
Edetate calcium disodium was granted FDA approval on 16 July 1953.7
- Accession Number
- DBSALT002785
- Structure
Structure for Edetate calcium disodium (DBSALT002785)
- Synonyms
- Calcium disodium (ethylenedinitrilo)tetraacetate dihydrate / Calcium disodium EDTA / Calcium disodium EDTA dihydrate / Calcium disodium ethylenediaminetetraacetate dihydrate / Calcium disodium versenate
- UNII
- 25IH6R4SGF
- CAS Number
- 6766-87-6
- Weight
- Average: 410.3
Monoisotopic: 410.0226242 - Chemical Formula
- C10H16CaN2Na2O10
- InChI Key
- JCQNARRMQCMKAN-UHFFFAOYSA-J
- InChI
- InChI=1S/C10H16N2O8.Ca.2Na.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/q;+2;2*+1;;/p-4
- IUPAC Name
- calcium disodium 2-({2-[bis(carboxymethyl)amino]ethyl}(carboxymethyl)amino)acetate dihydrate
- SMILES
- O.O.[Na+].[Na+].[Ca++].[O-]C(=O)CN(CCN(CC([O-])=O)CC([O-])=O)CC([O-])=O
- External Links
- ChemSpider
- 18932765
- Wikipedia
- Sodium_calcium_edetate
- Predicted Properties
Property Value Source Water Solubility 23.1 mg/mL ALOGPS logP 0.03 ALOGPS logP -4.9 Chemaxon logS -1.3 ALOGPS pKa (Strongest Acidic) 2.35 Chemaxon pKa (Strongest Basic) 7.73 Chemaxon Physiological Charge -3 Chemaxon Hydrogen Acceptor Count 10 Chemaxon Hydrogen Donor Count 0 Chemaxon Polar Surface Area 167 Å2 Chemaxon Rotatable Bond Count 11 Chemaxon Refractivity 105.69 m3·mol-1 Chemaxon Polarizability 24.52 Å3 Chemaxon Number of Rings 0 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon