O,O-Diethyl S-methyl dithiophosphate
TL;DR: O,O-Diethyl S-methyl dithiophosphate (CAS 3288-58-2) is a chemical compound with molecular formula C5H13O2PS2 and molecular weight 200.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethoxy-methylsulfanyl-sulfanylidene-λ5-phosphane
Also Known As: RCRA waste number U087, RCRA waste no. U087, O,O-DIETHYL S-METHYL DITHIOPHOSPHATE, O,O-diethyl S-methyl phosphorodithioate, O,O-Diethyl-S-methyl-dithiophosphate
| Molecular Formula | C5H13O2PS2 |
|---|---|
| Molecular Weight | 200.01 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 75.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 200.00946 |
| Heavy Atoms | 10 |
| Complexity | 119.0 |
Chemical Identifiers
| CAS Number | 3288-58-2 |
|---|---|
| SMILES | CCOP(=S)(OCC)SC |
| InChIKey | MXSZXPYMTRBCQT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
O,O-Diethyl S-methyl dithiophosphate (CAS 3288-58-2), with molecular formula C5H13O2PS2 and molecular weight 200.01 g/mol. IUPAC: diethoxy-methylsulfanyl-sulfanylidene-λ5-phosphane.
Chemical Property Profile of O,O-Diethyl S-methyl dithiophosphate
Property Insights of O,O-Diethyl S-methyl dithiophosphate
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for O,O-Diethyl S-methyl dithiophosphate. The TPSA of 75.9 Ų falls within the moderate polarity range, balancing permeability and solubility for O,O-Diethyl S-methyl dithiophosphate. Following Lipinski's Rule of Five, O,O-Diethyl S-methyl dithiophosphate 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 O,O-Diethyl S-methyl dithiophosphate?
The CAS number of O,O-Diethyl S-methyl dithiophosphate is 3288-58-2.
What is the molecular formula of O,O-Diethyl S-methyl dithiophosphate?
The molecular formula of O,O-Diethyl S-methyl dithiophosphate is C5H13O2PS2.
What is the molecular weight of O,O-Diethyl S-methyl dithiophosphate?
The molecular weight of O,O-Diethyl S-methyl dithiophosphate is 200.01 g/mol.
Where can I buy O,O-Diethyl S-methyl dithiophosphate?
You can request a quote for O,O-Diethyl S-methyl dithiophosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for O,O-Diethyl S-methyl dithiophosphate?
Yes, KEHONG BIO provides custom synthesis services for O,O-Diethyl S-methyl dithiophosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.