Trisodium etidronate
TL;DR: Trisodium etidronate (CAS 2666-14-0) is a chemical compound with molecular formula C2H5Na3O7P2 and molecular weight 271.92035 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
trisodium;hydroxy-(1-hydroxy-1-phosphonatoethyl)phosphinate
Also Known As: Trisodium etidronate, DEQUEST 2015DN, ETIDRONATE TRISODIUM, Phosphonic acid, (1-hydroxyethylidene)bis-, trisodium salt, (1-Hydroxyethylidene)diphosphonic acid, trisodium salt
Application Areas
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C2H5Na3O7P2 |
| Molecular Weight | 271.92035 g/mol |
| XLogP | -11.88 |
| Topological Polar Surface Area (TPSA) | 144.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 271.92035 Da |
| Heavy Atoms | 14 |
| Complexity | 221.0 |
| SMILES | CC(O)(P(=O)(O)[O-])P(=O)([O-])[O-].[Na+].[Na+].[Na+] |
| InChIKey | KCYJBQNPOFBNHE-UHFFFAOYSA-K |
Chemical Property Profile of Trisodium etidronate
Property Insights of Trisodium etidronate
The XLogP value of -11.88 indicates that Trisodium etidronate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 144.0 Ų indicates high polarity, suggesting Trisodium etidronate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Trisodium etidronate has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Trisodium etidronate?
The CAS number of Trisodium etidronate is 2666-14-0.
What is the molecular formula of Trisodium etidronate?
The molecular formula of Trisodium etidronate is C2H5Na3O7P2.
What is the molecular weight of Trisodium etidronate?
The molecular weight of Trisodium etidronate is 271.92035 g/mol.
Where can I buy Trisodium etidronate?
You can request a quote for Trisodium etidronate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Trisodium etidronate?
Yes, CoreyChem provides custom synthesis services for Trisodium etidronate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.