Dequest 2044
TL;DR: Dequest 2044 (CAS 91308-90-6) is a chemical compound with molecular formula C6H16K4N2O12P4 and molecular weight 587.82 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tetrapotassium;[2-[bis[[hydroxy(oxido)phosphoryl]methyl]amino]ethyl-[[hydroxy(oxido)phosphoryl]methyl]amino]methyl-hydroxyphosphinate
Also Known As: Dequest 2044, [ethylenebis[nitrilobis(methylene)]]tetrakisphosphonic acid, potassium salt, Phosphonic acid, (1,2-ethanediylbis(nitrilobis(methylene)))tetrakis-, potassium salt, Phosphonic acid, [1,2-ethanediylbis[nitrilobis(methylene)]]tetrakis-, potassium salt, phosphonic acid,(1,2-ethanediylbis(nitrilobis(methylene)))tetrakis-, tetrapotassium salt
| Molecular Formula | C6H16K4N2O12P4 |
|---|---|
| Molecular Weight | 587.82 g/mol |
| LogP | -16.3808 |
| Topological Polar Surface Area | 248.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 11 |
| Exact Mass | 587.8202 |
| Heavy Atoms | 28 |
| Complexity | 477.0 |
Chemical Identifiers
| CAS Number | 91308-90-6 |
|---|---|
| SMILES | C(CN(CP(=O)(O)[O-])CP(=O)(O)[O-])N(CP(=O)(O)[O-])CP(=O)(O)[O-].[K+].[K+].[K+].[K+] |
| InChIKey | AUMOSEQHACNXEW-UHFFFAOYSA-J |
Product Overview
Dequest 2044 (CAS 91308-90-6), with molecular formula C6H16K4N2O12P4 and molecular weight 587.82 g/mol. IUPAC: tetrapotassium;[2-[bis[[hydroxy(oxido)phosphoryl]methyl]amino]ethyl-[[hydroxy(oxido)phosphoryl]methyl]amino]methyl-hydroxyphosphinate.
Chemical Property Profile of Dequest 2044
Property Insights of Dequest 2044
The XLogP value of -16.3808 indicates that Dequest 2044 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 248.0 Ų indicates high polarity, suggesting Dequest 2044 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Dequest 2044 has 4 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dequest 2044?
The CAS number of Dequest 2044 is 91308-90-6.
What is the molecular formula of Dequest 2044?
The molecular formula of Dequest 2044 is C6H16K4N2O12P4.
What is the molecular weight of Dequest 2044?
The molecular weight of Dequest 2044 is 587.82 g/mol.
Where can I buy Dequest 2044?
You can request a quote for Dequest 2044 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dequest 2044?
Yes, KEHONG BIO provides custom synthesis services for Dequest 2044 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.