Triammonium hydrogen (1-hydroxyethylidene)bisphosphonate
TL;DR: Triammonium hydrogen (1-hydroxyethylidene)bisphosphonate (CAS 2809-20-3) is a chemical compound with molecular formula C2H17N3O7P2 and molecular weight 257.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
triazanium;hydroxy-(1-hydroxy-1-phosphonatoethyl)phosphinate
Also Known As: Etidronate triammonium, EINECS 220-551-2, Triammonium hydrogen (1-hydroxyethylidene)bisphosphonate, triammoniumhydrogen bisphosphonate, triammonium hydrogen 1-hydroxyethane-1,1-di-phosphonate
| Molecular Formula | C2H17N3O7P2 |
|---|---|
| Molecular Weight | 257.05 g/mol |
| LogP | -1.7596 |
| Topological Polar Surface Area | 253.28 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 257.05417 |
| Heavy Atoms | 14 |
| Complexity | 217.31946 |
Chemical Identifiers
| CAS Number | 2809-20-3 |
|---|---|
| SMILES | CC(O)(P(=O)(O)[O-])P(=O)([O-])[O-].[NH4+].[NH4+].[NH4+] |
Product Overview
Triammonium hydrogen (1-hydroxyethylidene)bisphosphonate (CAS 2809-20-3), with molecular formula C2H17N3O7P2 and molecular weight 257.05 g/mol. IUPAC: triazanium;hydroxy-(1-hydroxy-1-phosphonatoethyl)phosphinate.
Chemical Property Profile of Triammonium hydrogen (1-hydroxyethylidene)bisphosphonate
Property Insights of Triammonium hydrogen (1-hydroxyethylidene)bisphosphonate
The XLogP value of -1.7596 indicates that Triammonium hydrogen (1-hydroxyethylidene)bisphosphonate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 253.28 Ų indicates high polarity, suggesting Triammonium hydrogen (1-hydroxyethylidene)bisphosphonate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Triammonium hydrogen (1-hydroxyethylidene)bisphosphonate has 5 hydrogen bond donor(s) and 6 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 Triammonium hydrogen (1-hydroxyethylidene)bisphosphonate?
The CAS number of Triammonium hydrogen (1-hydroxyethylidene)bisphosphonate is 2809-20-3.
What is the molecular formula of Triammonium hydrogen (1-hydroxyethylidene)bisphosphonate?
The molecular formula of Triammonium hydrogen (1-hydroxyethylidene)bisphosphonate is C2H17N3O7P2.
What is the molecular weight of Triammonium hydrogen (1-hydroxyethylidene)bisphosphonate?
The molecular weight of Triammonium hydrogen (1-hydroxyethylidene)bisphosphonate is 257.05 g/mol.
Where can I buy Triammonium hydrogen (1-hydroxyethylidene)bisphosphonate?
You can request a quote for Triammonium hydrogen (1-hydroxyethylidene)bisphosphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Triammonium hydrogen (1-hydroxyethylidene)bisphosphonate?
Yes, KEHONG BIO provides custom synthesis services for Triammonium hydrogen (1-hydroxyethylidene)bisphosphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.