Dimethyl phosphorothioate
TL;DR: Dimethyl phosphorothioate (CAS 6345-18-2) is a chemical compound with molecular formula C2H7O3PS and molecular weight 141.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
hydroxy-dimethoxy-sulfanylidene-λ5-phosphane
Also Known As: DIMETHYL THIOPHOSPHATE, o,o-dimethyl thiophosphate, dimethylthiophosphate, Dmtp, dimethyl phosphorothioate
| Molecular Formula | C2H7O3PS |
|---|---|
| Molecular Weight | 141.99 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 70.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 141.98535 |
| Heavy Atoms | 7 |
| Complexity | 84.0 |
Chemical Identifiers
| CAS Number | 6345-18-2 |
|---|---|
| SMILES | COP(=S)(O)OC |
| InChIKey | WWJJVKAEQGGYHJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dimethyl phosphorothioate (CAS 6345-18-2), with molecular formula C2H7O3PS and molecular weight 141.99 g/mol. IUPAC: hydroxy-dimethoxy-sulfanylidene-λ5-phosphane.
Chemical Property Profile of Dimethyl phosphorothioate
Property Insights of Dimethyl phosphorothioate
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl phosphorothioate. The TPSA of 70.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl phosphorothioate. Following Lipinski's Rule of Five, Dimethyl 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 Dimethyl phosphorothioate?
The CAS number of Dimethyl phosphorothioate is 6345-18-2.
What is the molecular formula of Dimethyl phosphorothioate?
The molecular formula of Dimethyl phosphorothioate is C2H7O3PS.
What is the molecular weight of Dimethyl phosphorothioate?
The molecular weight of Dimethyl phosphorothioate is 141.99 g/mol.
Where can I buy Dimethyl phosphorothioate?
You can request a quote for Dimethyl phosphorothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl phosphorothioate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl phosphorothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.