Diethyl butylphosphonate
TL;DR: Diethyl butylphosphonate (CAS 2404-75-3) is a chemical compound with molecular formula C8H19O3P and molecular weight 194.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-diethoxyphosphorylbutane
Also Known As: Diethyl butylphosphonate, 1-diethoxyphosphorylbutane, DIETHYL 1-BUTYLPHOSPHONATE, Diethyl n-butanephosphonate, diethyl n-butylphosphonate
| Molecular Formula | C8H19O3P |
|---|---|
| Molecular Weight | 194.11 g/mol |
| LogP | 3.0526 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 194.10718 |
| Heavy Atoms | 12 |
| Complexity | 137.2384 |
Chemical Identifiers
| CAS Number | 2404-75-3 |
|---|---|
| SMILES | CCCCP(=O)(OCC)OCC |
Product Overview
Diethyl butylphosphonate (CAS 2404-75-3), with molecular formula C8H19O3P and molecular weight 194.11 g/mol. IUPAC: 1-diethoxyphosphorylbutane.
Chemical Property Profile of Diethyl butylphosphonate
Property Insights of Diethyl butylphosphonate
The XLogP value of 3.0526 indicates that Diethyl butylphosphonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, Diethyl butylphosphonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diethyl butylphosphonate has 0 hydrogen bond donor(s) and 3 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 Diethyl butylphosphonate?
The CAS number of Diethyl butylphosphonate is 2404-75-3.
What is the molecular formula of Diethyl butylphosphonate?
The molecular formula of Diethyl butylphosphonate is C8H19O3P.
What is the molecular weight of Diethyl butylphosphonate?
The molecular weight of Diethyl butylphosphonate is 194.11 g/mol.
Where can I buy Diethyl butylphosphonate?
You can request a quote for Diethyl butylphosphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl butylphosphonate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl butylphosphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.