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Hexaethyl [phosphoryltri(ethane-2,1-diyl)]tris(phosphonate)
TL;DR: Hexaethyl [phosphoryltri(ethane-2,1-diyl)]tris(phosphonate) (CAS 21627-00-9) is a chemical compound with molecular formula C18H42O10P4 and molecular weight 542.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[bis(2-diethoxyphosphorylethyl)phosphoryl]-2-diethoxyphosphorylethane
Also Known As: Hexaethyl [phosphoryltri(ethane-2,1-diyl)]tris(phosphonate), 1-[bis(2-diethoxyphosphorylethyl)phosphoryl]-2-diethoxyphosp, 1-[bis(2-diethoxyphosphorylethyl)phosphoryl]-2-diethoxyphosphorylethane
| Molecular Formula | C18H42O10P4 |
|---|---|
| Molecular Weight | 542.17 g/mol |
| LogP | -0.7 |
| Topological Polar Surface Area | 124.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 21 |
| Exact Mass | 542.17285 |
| Heavy Atoms | 32 |
| Complexity | 579.0 |
Chemical Identifiers
| CAS Number | 21627-00-9 |
|---|---|
| SMILES | CCOP(=O)(CCP(=O)(CCP(=O)(OCC)OCC)CCP(=O)(OCC)OCC)OCC |
| InChIKey | OYFROHXRNVCMSU-UHFFFAOYSA-N |
Product Overview
Hexaethyl [phosphoryltri(ethane-2,1-diyl)]tris(phosphonate) (CAS 21627-00-9), with molecular formula C18H42O10P4 and molecular weight 542.17 g/mol. IUPAC: 1-[bis(2-diethoxyphosphorylethyl)phosphoryl]-2-diethoxyphosphorylethane.
Chemical Property Profile of Hexaethyl [phosphoryltri(ethane-2,1-diyl)]tris(phosphonate)
Property Insights of Hexaethyl [phosphoryltri(ethane-2,1-diyl)]tris(phosphonate)
The XLogP value of -0.7 indicates that Hexaethyl [phosphoryltri(ethane-2,1-diyl)]tris(phosphonate) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Hexaethyl [phosphoryltri(ethane-2,1-diyl)]tris(phosphonate). Following Lipinski's Rule of Five, Hexaethyl [phosphoryltri(ethane-2,1-diyl)]tris(phosphonate) has 0 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Hexaethyl [phosphoryltri(ethane-2,1-diyl)]tris(phosphonate)?
The CAS number of Hexaethyl [phosphoryltri(ethane-2,1-diyl)]tris(phosphonate) is 21627-00-9.
What is the molecular formula of Hexaethyl [phosphoryltri(ethane-2,1-diyl)]tris(phosphonate)?
The molecular formula of Hexaethyl [phosphoryltri(ethane-2,1-diyl)]tris(phosphonate) is C18H42O10P4.
What is the molecular weight of Hexaethyl [phosphoryltri(ethane-2,1-diyl)]tris(phosphonate)?
The molecular weight of Hexaethyl [phosphoryltri(ethane-2,1-diyl)]tris(phosphonate) is 542.17 g/mol.
Where can I buy Hexaethyl [phosphoryltri(ethane-2,1-diyl)]tris(phosphonate)?
You can request a quote for Hexaethyl [phosphoryltri(ethane-2,1-diyl)]tris(phosphonate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexaethyl [phosphoryltri(ethane-2,1-diyl)]tris(phosphonate)?
Yes, KEHONG BIO provides custom synthesis services for Hexaethyl [phosphoryltri(ethane-2,1-diyl)]tris(phosphonate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.