Octaammonium (ethane-1,2-diylbis(nitrilobis(methylene)))tetrakisphosphonate
TL;DR: Octaammonium (ethane-1,2-diylbis(nitrilobis(methylene)))tetrakisphosphonate (CAS 68901-17-7) is a chemical compound with molecular formula C6H44N10O16P4 and molecular weight 636.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
octaazanium;[2-[bis(phosphonatooxymethyl)amino]ethyl-(phosphonatooxymethyl)amino]methyl phosphate
Also Known As: Octaammonium (ethane-1,2-diylbis(nitrilobis(methylene)))tetrakisphosphonate, Phosphonic acid, (1,2-ethanediylbis(nitrilobis(methylene)))tetrakis-, octaammonium salt, Octaammonium [ethane-1,2-diylbis[nitrilobis(methylene)]]tetrakisphosphonate, Phosphonic acid, P,P',P'',P'''-(1,2-ethanediylbis(nitrilobis(methylene)))tetrakis-, ammonium salt (1:8), Octaammonium[ethane-1,2-diylbis[nitrilobis(methylene)]]tetrakisphosphonate
| Molecular Formula | C6H44N10O16P4 |
|---|---|
| Molecular Weight | 636.19 g/mol |
| LogP | -4.1888 |
| Topological Polar Surface Area | 304.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 11 |
| Exact Mass | 636.1887 |
| Heavy Atoms | 36 |
| Complexity | 493.0 |
Chemical Identifiers
| CAS Number | 68901-17-7 |
|---|---|
| SMILES | C(CN(COP(=O)([O-])[O-])COP(=O)([O-])[O-])N(COP(=O)([O-])[O-])COP(=O)([O-])[O-].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+] |
| InChIKey | GHGNKSYLWFCTJW-UHFFFAOYSA-N |
Product Overview
Octaammonium (ethane-1,2-diylbis(nitrilobis(methylene)))tetrakisphosphonate (CAS 68901-17-7), with molecular formula C6H44N10O16P4 and molecular weight 636.19 g/mol. IUPAC: octaazanium;[2-[bis(phosphonatooxymethyl)amino]ethyl-(phosphonatooxymethyl)amino]methyl phosphate.
Chemical Property Profile of Octaammonium (ethane-1,2-diylbis(nitrilobis(methylene)))tetrakisphosphonate
Property Insights of Octaammonium (ethane-1,2-diylbis(nitrilobis(methylene)))tetrakisphosphonate
The XLogP value of -4.1888 indicates that Octaammonium (ethane-1,2-diylbis(nitrilobis(methylene)))tetrakisphosphonate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 304.0 Ų indicates high polarity, suggesting Octaammonium (ethane-1,2-diylbis(nitrilobis(methylene)))tetrakisphosphonate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Octaammonium (ethane-1,2-diylbis(nitrilobis(methylene)))tetrakisphosphonate has 8 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Octaammonium (ethane-1,2-diylbis(nitrilobis(methylene)))tetrakisphosphonate?
The CAS number of Octaammonium (ethane-1,2-diylbis(nitrilobis(methylene)))tetrakisphosphonate is 68901-17-7.
What is the molecular formula of Octaammonium (ethane-1,2-diylbis(nitrilobis(methylene)))tetrakisphosphonate?
The molecular formula of Octaammonium (ethane-1,2-diylbis(nitrilobis(methylene)))tetrakisphosphonate is C6H44N10O16P4.
What is the molecular weight of Octaammonium (ethane-1,2-diylbis(nitrilobis(methylene)))tetrakisphosphonate?
The molecular weight of Octaammonium (ethane-1,2-diylbis(nitrilobis(methylene)))tetrakisphosphonate is 636.19 g/mol.
Where can I buy Octaammonium (ethane-1,2-diylbis(nitrilobis(methylene)))tetrakisphosphonate?
You can request a quote for Octaammonium (ethane-1,2-diylbis(nitrilobis(methylene)))tetrakisphosphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Octaammonium (ethane-1,2-diylbis(nitrilobis(methylene)))tetrakisphosphonate?
Yes, KEHONG BIO provides custom synthesis services for Octaammonium (ethane-1,2-diylbis(nitrilobis(methylene)))tetrakisphosphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.