O,S-Diethyl phosphorothioate
TL;DR: O,S-Diethyl phosphorothioate (CAS 55882-44-5) is a chemical compound with molecular formula C4H11O3PS and molecular weight 170.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethoxy(ethylsulfanyl)phosphinic acid
Also Known As: O,S-Diethyl phosphorothioate, o,s-diethyl hydrogen phosphorothioate, ethoxy(ethylsulfanyl)phosphinic acid, Ethoxy-ethylsulfanyl-phosphinic Acid, Phosphorothioic acid, O,S-diethyl ester
| Molecular Formula | C4H11O3PS |
|---|---|
| Molecular Weight | 170.02 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 71.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 170.01665 |
| Heavy Atoms | 9 |
| Complexity | 116.0 |
Chemical Identifiers
| CAS Number | 55882-44-5 |
|---|---|
| SMILES | CCOP(=O)(O)SCC |
| InChIKey | ABAVGUUOJKWRSK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
O,S-Diethyl phosphorothioate (CAS 55882-44-5), with molecular formula C4H11O3PS and molecular weight 170.02 g/mol. IUPAC: ethoxy(ethylsulfanyl)phosphinic acid.
Chemical Property Profile of O,S-Diethyl phosphorothioate
Property Insights of O,S-Diethyl phosphorothioate
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for O,S-Diethyl phosphorothioate. The TPSA of 71.8 Ų falls within the moderate polarity range, balancing permeability and solubility for O,S-Diethyl phosphorothioate. Following Lipinski's Rule of Five, O,S-Diethyl phosphorothioate has 1 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 O,S-Diethyl phosphorothioate?
The CAS number of O,S-Diethyl phosphorothioate is 55882-44-5.
What is the molecular formula of O,S-Diethyl phosphorothioate?
The molecular formula of O,S-Diethyl phosphorothioate is C4H11O3PS.
What is the molecular weight of O,S-Diethyl phosphorothioate?
The molecular weight of O,S-Diethyl phosphorothioate is 170.02 g/mol.
Where can I buy O,S-Diethyl phosphorothioate?
You can request a quote for O,S-Diethyl phosphorothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for O,S-Diethyl phosphorothioate?
Yes, KEHONG BIO provides custom synthesis services for O,S-Diethyl phosphorothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.