Tetrabutyl ethane-1,2-diylbis(phosphonate)
TL;DR: Tetrabutyl ethane-1,2-diylbis(phosphonate) (CAS 919-48-2) is a chemical compound with molecular formula C18H40O6P2 and molecular weight 414.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[butoxy(2-dibutoxyphosphorylethyl)phosphoryl]oxybutane
Also Known As: Tetra-n-butylEthylendiphosphonat, tetrabutyl ethane-1,2-diylbis(phosphonate), Ethylen-1,2-diphosphonsaeure-tetrabutylester, 1-[butoxy(2-dibutoxyphosphorylethyl)phosphoryl]oxybutane, Phosphonic acid, P,P'-1,2-ethanediylbis-, tetrabutyl ester
| Molecular Formula | C18H40O6P2 |
|---|---|
| Molecular Weight | 414.23 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 71.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 19 |
| Exact Mass | 414.23 |
| Heavy Atoms | 26 |
| Complexity | 350.0 |
Chemical Identifiers
| CAS Number | 919-48-2 |
|---|---|
| SMILES | CCCCOP(=O)(CCP(=O)(OCCCC)OCCCC)OCCCC |
| InChIKey | JBXXIXHWXNNCOS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Tetrabutyl ethane-1,2-diylbis(phosphonate) (CAS 919-48-2), with molecular formula C18H40O6P2 and molecular weight 414.23 g/mol. IUPAC: 1-[butoxy(2-dibutoxyphosphorylethyl)phosphoryl]oxybutane.
Chemical Property Profile of Tetrabutyl ethane-1,2-diylbis(phosphonate)
Property Insights of Tetrabutyl ethane-1,2-diylbis(phosphonate)
The XLogP value of 3.7 indicates that Tetrabutyl ethane-1,2-diylbis(phosphonate) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Tetrabutyl ethane-1,2-diylbis(phosphonate). Following Lipinski's Rule of Five, Tetrabutyl ethane-1,2-diylbis(phosphonate) has 0 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 Tetrabutyl ethane-1,2-diylbis(phosphonate)?
The CAS number of Tetrabutyl ethane-1,2-diylbis(phosphonate) is 919-48-2.
What is the molecular formula of Tetrabutyl ethane-1,2-diylbis(phosphonate)?
The molecular formula of Tetrabutyl ethane-1,2-diylbis(phosphonate) is C18H40O6P2.
What is the molecular weight of Tetrabutyl ethane-1,2-diylbis(phosphonate)?
The molecular weight of Tetrabutyl ethane-1,2-diylbis(phosphonate) is 414.23 g/mol.
Where can I buy Tetrabutyl ethane-1,2-diylbis(phosphonate)?
You can request a quote for Tetrabutyl ethane-1,2-diylbis(phosphonate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tetrabutyl ethane-1,2-diylbis(phosphonate)?
Yes, KEHONG BIO provides custom synthesis services for Tetrabutyl ethane-1,2-diylbis(phosphonate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.