![Diethyl[3-(2,4-dichlorophenoxy)propyl]phosphonate structure](/static/products/869/86944-32-3.png)
Diethyl[3-(2,4-dichlorophenoxy)propyl]phosphonate
TL;DR: Diethyl[3-(2,4-dichlorophenoxy)propyl]phosphonate (CAS 86944-32-3) is a chemical compound with molecular formula C13H19Cl2O4P and molecular weight 340.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dichloro-1-(3-diethoxyphosphorylpropoxy)benzene
Also Known As: diethyl[3-(2,4-dichlorophenoxy)propyl]phosphonate, 2,4-dichloro-1-(3-diethoxyphosphorylpropoxy)benzene, Diethyl (3-(2,4-dichlorophenoxy)propyl)phosphonate, diethyl [3-(2,4-dichlorophenoxy)propyl]phosphonate
| Molecular Formula | C13H19Cl2O4P |
|---|---|
| Molecular Weight | 340.04 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 340.0398 |
| Heavy Atoms | 20 |
| Complexity | 307.0 |
Chemical Identifiers
| CAS Number | 86944-32-3 |
|---|---|
| SMILES | CCOP(=O)(CCCOC1=C(C=C(C=C1)Cl)Cl)OCC |
| InChIKey | ROHHOMHGFMWSFV-UHFFFAOYSA-N |
Product Overview
Diethyl[3-(2,4-dichlorophenoxy)propyl]phosphonate (CAS 86944-32-3), with molecular formula C13H19Cl2O4P and molecular weight 340.04 g/mol. IUPAC: 2,4-dichloro-1-(3-diethoxyphosphorylpropoxy)benzene.
Chemical Property Profile of Diethyl[3-(2,4-dichlorophenoxy)propyl]phosphonate
Property Insights of Diethyl[3-(2,4-dichlorophenoxy)propyl]phosphonate
The XLogP value of 4.0 indicates that Diethyl[3-(2,4-dichlorophenoxy)propyl]phosphonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.8 Ų, Diethyl[3-(2,4-dichlorophenoxy)propyl]phosphonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diethyl[3-(2,4-dichlorophenoxy)propyl]phosphonate has 0 hydrogen bond donor(s) and 4 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[3-(2,4-dichlorophenoxy)propyl]phosphonate?
The CAS number of Diethyl[3-(2,4-dichlorophenoxy)propyl]phosphonate is 86944-32-3.
What is the molecular formula of Diethyl[3-(2,4-dichlorophenoxy)propyl]phosphonate?
The molecular formula of Diethyl[3-(2,4-dichlorophenoxy)propyl]phosphonate is C13H19Cl2O4P.
What is the molecular weight of Diethyl[3-(2,4-dichlorophenoxy)propyl]phosphonate?
The molecular weight of Diethyl[3-(2,4-dichlorophenoxy)propyl]phosphonate is 340.04 g/mol.
Where can I buy Diethyl[3-(2,4-dichlorophenoxy)propyl]phosphonate?
You can request a quote for Diethyl[3-(2,4-dichlorophenoxy)propyl]phosphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl[3-(2,4-dichlorophenoxy)propyl]phosphonate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl[3-(2,4-dichlorophenoxy)propyl]phosphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.