Neodymium edetate
TL;DR: Neodymium edetate (CAS 12611-51-7) is a chemical compound with molecular formula C10H13N2NdO8 and molecular weight 430.9749 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[2-[bis(carboxylatomethyl)amino]ethyl-(carboxymethyl)amino]acetate;neodymium(3+)
Also Known As: Neodymium edetate, H-PHE(P-COOH)-OH, Neodymium ethylenediaminetetraacetate, neodymium 2,2'-({2-[(carboxylatomethyl)(carboxymethyl)amino]ethyl}imino)diacetate, Neodymate(1-), ((N,N'-1,2-ethanediylbis(N-((carboxy-kappaO)methyl)glycinato-kappaN,kappaO)(4-))-, hydrogen, (OC-6-21)-
Technical Specifications
| Molecular Formula | C10H13N2NdO8 |
| Molecular Weight | 430.9749 g/mol |
| XLogP | -6.08 |
| Topological Polar Surface Area (TPSA) | 164.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 430.9749 Da |
| Heavy Atoms | 21 |
| Complexity | 351.0 |
| SMILES | C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)O)CC(=O)[O-].[Nd+3] |
| InChIKey | QGSNBBYVXDXAOD-UHFFFAOYSA-K |
Chemical Property Profile of Neodymium edetate
Property Insights of Neodymium edetate
The XLogP value of -6.08 indicates that Neodymium edetate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 164.0 Ų indicates high polarity, suggesting Neodymium edetate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Neodymium edetate has 1 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Neodymium edetate?
The CAS number of Neodymium edetate is 12611-51-7.
What is the molecular formula of Neodymium edetate?
The molecular formula of Neodymium edetate is C10H13N2NdO8.
What is the molecular weight of Neodymium edetate?
The molecular weight of Neodymium edetate is 430.9749 g/mol.
Where can I buy Neodymium edetate?
You can request a quote for Neodymium edetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Neodymium edetate?
Yes, CoreyChem provides custom synthesis services for Neodymium edetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.