![Diethyl P-[[[(4-methylphenyl)sulfonyl]oxy]methyl]phosphonate structure](/static/products/3161/31618-90-3.webp)
Diethyl P-[[[(4-methylphenyl)sulfonyl]oxy]methyl]phosphonate
TL;DR: Diethyl P-[[[(4-methylphenyl)sulfonyl]oxy]methyl]phosphonate (CAS 31618-90-3) is a chemical compound with molecular formula C12H19O6PS and molecular weight 322.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethoxyphosphorylmethyl 4-methylbenzenesulfonate
Also Known As: Diethyl (tosyloxy)methylphosphonate, (Diethoxyphosphoryl)methyl 4-methylbenzenesulfonate, diethoxyphosphorylmethyl 4-methylbenzenesulfonate, Tosyloxymethyl Diethyl Phosphonate, Diethyl 4-toluenesulfonyloxymethylphosphonate
| Molecular Formula | C12H19O6PS |
|---|---|
| Molecular Weight | 322.06 g/mol |
| LogP | 2.92392 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 322.064 |
| Heavy Atoms | 20 |
| Complexity | 556.1153 |
Chemical Identifiers
| CAS Number | 31618-90-3 |
|---|---|
| SMILES | CCOP(=O)(COS(=O)(=O)C1=CC=C(C=C1)C)OCC |
Product Overview
Diethyl P-[[[(4-methylphenyl)sulfonyl]oxy]methyl]phosphonate (CAS 31618-90-3), with molecular formula C12H19O6PS and molecular weight 322.06 g/mol. IUPAC: diethoxyphosphorylmethyl 4-methylbenzenesulfonate.
Chemical Property Profile of Diethyl P-[[[(4-methylphenyl)sulfonyl]oxy]methyl]phosphonate
Property Insights of Diethyl P-[[[(4-methylphenyl)sulfonyl]oxy]methyl]phosphonate
The XLogP value of 2.92392 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl P-[[[(4-methylphenyl)sulfonyl]oxy]methyl]phosphonate. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl P-[[[(4-methylphenyl)sulfonyl]oxy]methyl]phosphonate. Following Lipinski's Rule of Five, Diethyl P-[[[(4-methylphenyl)sulfonyl]oxy]methyl]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 Diethyl P-[[[(4-methylphenyl)sulfonyl]oxy]methyl]phosphonate?
The CAS number of Diethyl P-[[[(4-methylphenyl)sulfonyl]oxy]methyl]phosphonate is 31618-90-3.
What is the molecular formula of Diethyl P-[[[(4-methylphenyl)sulfonyl]oxy]methyl]phosphonate?
The molecular formula of Diethyl P-[[[(4-methylphenyl)sulfonyl]oxy]methyl]phosphonate is C12H19O6PS.
What is the molecular weight of Diethyl P-[[[(4-methylphenyl)sulfonyl]oxy]methyl]phosphonate?
The molecular weight of Diethyl P-[[[(4-methylphenyl)sulfonyl]oxy]methyl]phosphonate is 322.06 g/mol.
Where can I buy Diethyl P-[[[(4-methylphenyl)sulfonyl]oxy]methyl]phosphonate?
You can request a quote for Diethyl P-[[[(4-methylphenyl)sulfonyl]oxy]methyl]phosphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl P-[[[(4-methylphenyl)sulfonyl]oxy]methyl]phosphonate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl P-[[[(4-methylphenyl)sulfonyl]oxy]methyl]phosphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.