O,O-Diethyl dithiophosphate
TL;DR: O,O-Diethyl dithiophosphate (CAS 298-06-6) is a chemical compound with molecular formula C4H11O2PS2 and molecular weight 185.9938 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
diethoxy-sulfanyl-sulfanylidene-λ5-phosphane
Also Known As: O,O-Diethyl dithiophosphate, Diethyl dithiophosphate, diethylphosphorodithioate, O,O'-Diethyl dithiophosphate, Diethyl phosphorodithioate
Application Areas
Top 5 of 19 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C4H11O2PS2 |
| Molecular Weight | 185.9938 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 51.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 185.9938 Da |
| Heavy Atoms | 9 |
| Complexity | 107.0 |
| Vapor Pressure | 0.05 [mmHg] |
| SMILES | CCOP(=S)(OCC)S |
| InChIKey | IRDLUHRVLVEUHA-UHFFFAOYSA-N |
Product Description
Applications: O,O-Diethyl dithiophosphate is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies O,O-Diethyl dithiophosphate (CAS 298-06-6) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
O,O-Diethyl dithiophosphate is a heterocyclic building block identified by CAS number 298-06-6 and the molecular formula C4H11O2PS2 and a molecular weight of 185.99 g/mol. It is also known as O,O-Diethyl dithiophosphate and Diethyl dithiophosphate.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of O,O-Diethyl dithiophosphate
Property Insights of O,O-Diethyl dithiophosphate
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for O,O-Diethyl dithiophosphate. With a topological polar surface area (TPSA) of 51.6 Ų, O,O-Diethyl dithiophosphate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, O,O-Diethyl dithiophosphate 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
What is the CAS number of O,O-Diethyl dithiophosphate?
The CAS number of O,O-Diethyl dithiophosphate is 298-06-6.
What is the molecular formula of O,O-Diethyl dithiophosphate?
The molecular formula of O,O-Diethyl dithiophosphate is C4H11O2PS2.
What is the molecular weight of O,O-Diethyl dithiophosphate?
The molecular weight of O,O-Diethyl dithiophosphate is 185.9938 g/mol.
What are the applications of O,O-Diethyl dithiophosphate?
O,O-Diethyl dithiophosphate is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies O,O-Diethyl dithiophosphate...
Where can I buy O,O-Diethyl dithiophosphate?
You can request a quote for O,O-Diethyl dithiophosphate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for O,O-Diethyl dithiophosphate?
Yes, CoreyChem provides custom synthesis services for O,O-Diethyl dithiophosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.