Dimethyl tetrathiooxalate
TL;DR: Dimethyl tetrathiooxalate (CAS 61485-47-0) is a chemical compound with molecular formula C4H6S4 and molecular weight 181.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl ethanebis(dithioate)
Also Known As: Dimethyl tetrathiooxalate, Dimethyl ethanedidithioate, dimethyl ethanebis(dithioate), Dimethyl ethanedidithioate #, Tetrathiooxalsaeure-dimethylester
| Molecular Formula | C4H6S4 |
|---|---|
| Molecular Weight | 181.94 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 115.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 181.93524 |
| Heavy Atoms | 8 |
| Complexity | 92.0 |
Chemical Identifiers
| CAS Number | 61485-47-0 |
|---|---|
| SMILES | CSC(=S)C(=S)SC |
| InChIKey | JPEQRYNXCNLOAJ-UHFFFAOYSA-N |
Product Overview
Dimethyl tetrathiooxalate (CAS 61485-47-0), with molecular formula C4H6S4 and molecular weight 181.94 g/mol. IUPAC: dimethyl ethanebis(dithioate).
Chemical Property Profile of Dimethyl tetrathiooxalate
Property Insights of Dimethyl tetrathiooxalate
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl tetrathiooxalate. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl tetrathiooxalate. Following Lipinski's Rule of Five, Dimethyl tetrathiooxalate 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 Dimethyl tetrathiooxalate?
The CAS number of Dimethyl tetrathiooxalate is 61485-47-0.
What is the molecular formula of Dimethyl tetrathiooxalate?
The molecular formula of Dimethyl tetrathiooxalate is C4H6S4.
What is the molecular weight of Dimethyl tetrathiooxalate?
The molecular weight of Dimethyl tetrathiooxalate is 181.94 g/mol.
Where can I buy Dimethyl tetrathiooxalate?
You can request a quote for Dimethyl tetrathiooxalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl tetrathiooxalate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl tetrathiooxalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.