Diethyl xanthate
TL;DR: Diethyl xanthate (CAS 623-79-0) is a chemical compound with molecular formula C5H10OS2 and molecular weight 150.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
O-ethyl ethylsulfanylmethanethioate
Also Known As: O,S-Diethyl dithiocarbonate, Diethyl xanthate, Ethyl O-ethylxanthate, ethoxy(ethylsulfanyl)methanethione, Ethyl S-ethyl xanthate
| Molecular Formula | C5H10OS2 |
|---|---|
| Molecular Weight | 150.02 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 66.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 150.0173 |
| Heavy Atoms | 8 |
| Complexity | 72.0 |
Chemical Identifiers
| CAS Number | 623-79-0 |
|---|---|
| SMILES | CCOC(=S)SCC |
| InChIKey | JGZZEAPGGFAOAY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Diethyl xanthate (CAS 623-79-0), with molecular formula C5H10OS2 and molecular weight 150.02 g/mol. IUPAC: O-ethyl ethylsulfanylmethanethioate.
Chemical Property Profile of Diethyl xanthate
Property Insights of Diethyl xanthate
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl xanthate. The TPSA of 66.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl xanthate. Following Lipinski's Rule of Five, Diethyl xanthate has 0 hydrogen bond donor(s) and 3 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 Diethyl xanthate?
The CAS number of Diethyl xanthate is 623-79-0.
What is the molecular formula of Diethyl xanthate?
The molecular formula of Diethyl xanthate is C5H10OS2.
What is the molecular weight of Diethyl xanthate?
The molecular weight of Diethyl xanthate is 150.02 g/mol.
Where can I buy Diethyl xanthate?
You can request a quote for Diethyl xanthate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl xanthate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl xanthate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.