O,O-Diethyl O,S-dimethyl thiodiphosphate
TL;DR: O,O-Diethyl O,S-dimethyl thiodiphosphate (CAS 3348-67-2) is a chemical compound with molecular formula C6H16O6P2S and molecular weight 278.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl [methoxy(methylsulfanyl)phosphoryl] phosphate
Also Known As: Ethyl methyl thiopyrophosphate, O,O-diethyl O,S-dimethyl thiodiphosphate, diethyl [methoxy(methylsulfanyl)phosphoryl] phosphate, Thiopyrophosphoric acid, O,O-diethyl O',S'-dimethyl ester, Ethyl methyl thiopyrophosphate ((Eto)2P(O)OP(O)(OMe)(SMe))
| Molecular Formula | C6H16O6P2S |
|---|---|
| Molecular Weight | 278.01 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 96.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 278.01428 |
| Heavy Atoms | 15 |
| Complexity | 260.0 |
Chemical Identifiers
| CAS Number | 3348-67-2 |
|---|---|
| SMILES | CCOP(=O)(OCC)OP(=O)(OC)SC |
| InChIKey | XUQMJWHBMXWRCI-UHFFFAOYSA-N |
Product Overview
O,O-Diethyl O,S-dimethyl thiodiphosphate (CAS 3348-67-2), with molecular formula C6H16O6P2S and molecular weight 278.01 g/mol. IUPAC: diethyl [methoxy(methylsulfanyl)phosphoryl] phosphate.
Chemical Property Profile of O,O-Diethyl O,S-dimethyl thiodiphosphate
Property Insights of O,O-Diethyl O,S-dimethyl thiodiphosphate
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for O,O-Diethyl O,S-dimethyl thiodiphosphate. The TPSA of 96.4 Ų falls within the moderate polarity range, balancing permeability and solubility for O,O-Diethyl O,S-dimethyl thiodiphosphate. Following Lipinski's Rule of Five, O,O-Diethyl O,S-dimethyl thiodiphosphate has 0 hydrogen bond donor(s) and 7 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 O,S-dimethyl thiodiphosphate?
The CAS number of O,O-Diethyl O,S-dimethyl thiodiphosphate is 3348-67-2.
What is the molecular formula of O,O-Diethyl O,S-dimethyl thiodiphosphate?
The molecular formula of O,O-Diethyl O,S-dimethyl thiodiphosphate is C6H16O6P2S.
What is the molecular weight of O,O-Diethyl O,S-dimethyl thiodiphosphate?
The molecular weight of O,O-Diethyl O,S-dimethyl thiodiphosphate is 278.01 g/mol.
Where can I buy O,O-Diethyl O,S-dimethyl thiodiphosphate?
You can request a quote for O,O-Diethyl O,S-dimethyl thiodiphosphate 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 O,S-dimethyl thiodiphosphate?
Yes, KEHONG BIO provides custom synthesis services for O,O-Diethyl O,S-dimethyl thiodiphosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.