二乙基硫代二碳酸酯
TL;DR: 二乙基硫代二碳酸酯 (CAS 2905-52-4) is a chemical compound with molecular formula C6H10O2S3 and molecular weight 209.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二乙基硫代二碳酸酯
O-ethyl ethoxycarbothioylsulfanylmethanethioate
Also Known As: Diethyl thiodicarbonate, Chlorotoluron, Bis(ethoxythiocarbonyl)sulfide, o,o-diethyl trithiodicarbonate, bis(ethoxythiocarbonyl)sulfur
| Molecular Formula | C6H10O2S3 |
|---|---|
| Molecular Weight | 209.98 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 108.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 209.9843 |
| Heavy Atoms | 11 |
| Complexity | 131.0 |
Chemical Identifiers
| CAS Number | 2905-52-4 |
|---|---|
| SMILES | CCOC(=S)SC(=S)OCC |
| InChIKey | ALGQDBJUFSYDLA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
二乙基硫代二碳酸酯 (CAS 2905-52-4), with molecular formula C6H10O2S3 and molecular weight 209.98 g/mol. IUPAC: O-ethyl ethoxycarbothioylsulfanylmethanethioate.
Chemical Property Profile of 二乙基硫代二碳酸酯
Property Insights of 二乙基硫代二碳酸酯
The XLogP value of 3.2 indicates that 二乙基硫代二碳酸酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 二乙基硫代二碳酸酯. Following Lipinski's Rule of Five, 二乙基硫代二碳酸酯 has 0 hydrogen bond donor(s) and 5 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 二乙基硫代二碳酸酯?
The CAS number of 二乙基硫代二碳酸酯 is 2905-52-4.
What is the molecular formula of 二乙基硫代二碳酸酯?
The molecular formula of 二乙基硫代二碳酸酯 is C6H10O2S3.
What is the molecular weight of 二乙基硫代二碳酸酯?
The molecular weight of 二乙基硫代二碳酸酯 is 209.98 g/mol.
Where can I buy 二乙基硫代二碳酸酯?
You can request a quote for 二乙基硫代二碳酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二乙基硫代二碳酸酯?
Yes, KEHONG BIO provides custom synthesis services for 二乙基硫代二碳酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.