(Diethoxyphosphoryl)methyl 4-chlorobenzenesulfonate
TL;DR: (Diethoxyphosphoryl)methyl 4-chlorobenzenesulfonate (CAS 35449-95-7) is a chemical compound with molecular formula C11H16ClO6PS and molecular weight 342.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethoxyphosphorylmethyl 4-chlorobenzenesulfonate
Also Known As: (Diethoxyphosphoryl)methyl 4-chlorobenzenesulfonate, (Diethoxyphosphoryl)-methyl 4-chlorobenzenesulfonate, 1-chloro-4-(diethoxyphosphorylmethoxysulfonyl)benzene, [bis(ethyloxy)phosphoryl]methyl 4-chlorobenzenesulfonate, 4-chlorobenzenesulfonyloxymethylphosphonate diethyl ester
| Molecular Formula | C11H16ClO6PS |
|---|---|
| Molecular Weight | 342.01 g/mol |
| LogP | 3.2689 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 342.00937 |
| Heavy Atoms | 20 |
| Complexity | 561.08105 |
Chemical Identifiers
| CAS Number | 35449-95-7 |
|---|---|
| SMILES | CCOP(=O)(COS(=O)(=O)C1=CC=C(C=C1)Cl)OCC |
Product Overview
(Diethoxyphosphoryl)methyl 4-chlorobenzenesulfonate (CAS 35449-95-7), with molecular formula C11H16ClO6PS and molecular weight 342.01 g/mol. IUPAC: diethoxyphosphorylmethyl 4-chlorobenzenesulfonate.
Chemical Property Profile of (Diethoxyphosphoryl)methyl 4-chlorobenzenesulfonate
Property Insights of (Diethoxyphosphoryl)methyl 4-chlorobenzenesulfonate
The XLogP value of 3.2689 indicates that (Diethoxyphosphoryl)methyl 4-chlorobenzenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for (Diethoxyphosphoryl)methyl 4-chlorobenzenesulfonate. Following Lipinski's Rule of Five, (Diethoxyphosphoryl)methyl 4-chlorobenzenesulfonate 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 (Diethoxyphosphoryl)methyl 4-chlorobenzenesulfonate?
The CAS number of (Diethoxyphosphoryl)methyl 4-chlorobenzenesulfonate is 35449-95-7.
What is the molecular formula of (Diethoxyphosphoryl)methyl 4-chlorobenzenesulfonate?
The molecular formula of (Diethoxyphosphoryl)methyl 4-chlorobenzenesulfonate is C11H16ClO6PS.
What is the molecular weight of (Diethoxyphosphoryl)methyl 4-chlorobenzenesulfonate?
The molecular weight of (Diethoxyphosphoryl)methyl 4-chlorobenzenesulfonate is 342.01 g/mol.
Where can I buy (Diethoxyphosphoryl)methyl 4-chlorobenzenesulfonate?
You can request a quote for (Diethoxyphosphoryl)methyl 4-chlorobenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Diethoxyphosphoryl)methyl 4-chlorobenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for (Diethoxyphosphoryl)methyl 4-chlorobenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.