![Tetrasodium 2-[phosphonato(phosphono)methyl]butanedioate structure](/static/products/9777/97772-98-0.webp)
Tetrasodium 2-[phosphonato(phosphono)methyl]butanedioate
TL;DR: Tetrasodium 2-[phosphonato(phosphono)methyl]butanedioate (CAS 97772-98-0) is a chemical compound with molecular formula C5H6Na4O10P2 and molecular weight 379.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tetrasodium;2-[phosphonato(phosphono)methyl]butanedioate
Also Known As: Teceos (TN), Butedronate tetrasodium, Butedronate tetrasodium (USAN), tetrasodium 2-[phosphonato(phosphono)methyl]butanedioate, tetrasodium;2-[phosphonato(phosphono)methyl]butanedioate
| Molecular Formula | C5H6Na4O10P2 |
|---|---|
| Molecular Weight | 379.90 g/mol |
| LogP | -17.074 |
| Topological Polar Surface Area | 201.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 3 |
| Exact Mass | 379.9027 |
| Heavy Atoms | 21 |
| Complexity | 380.0 |
Chemical Identifiers
| CAS Number | 97772-98-0 |
|---|---|
| SMILES | C(C(C(P(=O)(O)O)P(=O)([O-])[O-])C(=O)[O-])C(=O)[O-].[Na+].[Na+].[Na+].[Na+] |
| InChIKey | WQVCHXLTSYVIPX-UHFFFAOYSA-J |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Tetrasodium 2-[phosphonato(phosphono)methyl]butanedioate (CAS 97772-98-0), with molecular formula C5H6Na4O10P2 and molecular weight 379.90 g/mol. IUPAC: tetrasodium;2-[phosphonato(phosphono)methyl]butanedioate.
Chemical Property Profile of Tetrasodium 2-[phosphonato(phosphono)methyl]butanedioate
Property Insights of Tetrasodium 2-[phosphonato(phosphono)methyl]butanedioate
The XLogP value of -17.074 indicates that Tetrasodium 2-[phosphonato(phosphono)methyl]butanedioate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 201.0 Ų indicates high polarity, suggesting Tetrasodium 2-[phosphonato(phosphono)methyl]butanedioate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Tetrasodium 2-[phosphonato(phosphono)methyl]butanedioate has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Tetrasodium 2-[phosphonato(phosphono)methyl]butanedioate?
The CAS number of Tetrasodium 2-[phosphonato(phosphono)methyl]butanedioate is 97772-98-0.
What is the molecular formula of Tetrasodium 2-[phosphonato(phosphono)methyl]butanedioate?
The molecular formula of Tetrasodium 2-[phosphonato(phosphono)methyl]butanedioate is C5H6Na4O10P2.
What is the molecular weight of Tetrasodium 2-[phosphonato(phosphono)methyl]butanedioate?
The molecular weight of Tetrasodium 2-[phosphonato(phosphono)methyl]butanedioate is 379.90 g/mol.
Where can I buy Tetrasodium 2-[phosphonato(phosphono)methyl]butanedioate?
You can request a quote for Tetrasodium 2-[phosphonato(phosphono)methyl]butanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tetrasodium 2-[phosphonato(phosphono)methyl]butanedioate?
Yes, KEHONG BIO provides custom synthesis services for Tetrasodium 2-[phosphonato(phosphono)methyl]butanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.