二甲基三硫代碳酸酯
TL;DR: 二甲基三硫代碳酸酯 (CAS 2314-48-9) is a chemical compound with molecular formula C3H6S3 and molecular weight 137.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二甲基三硫代碳酸酯
bis(methylsulfanyl)methanethione
Also Known As: Dimethyl trithiocarbonate, Fenquizone, Carbonotrithioic acid, dimethyl ester, dimethyl carbonotrithioate, bis(methylsulfanyl)methanethione
| Molecular Formula | C3H6S3 |
|---|---|
| Molecular Weight | 137.96 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 82.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 137.96317 |
| Heavy Atoms | 6 |
| Complexity | 44.0 |
Chemical Identifiers
| CAS Number | 2314-48-9 |
|---|---|
| SMILES | CSC(=S)SC |
| InChIKey | IQWMXKTYXNMSLC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
二甲基三硫代碳酸酯 (CAS 2314-48-9), with molecular formula C3H6S3 and molecular weight 137.96 g/mol. IUPAC: bis(methylsulfanyl)methanethione.
Chemical Property Profile of 二甲基三硫代碳酸酯
Property Insights of 二甲基三硫代碳酸酯
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 二甲基三硫代碳酸酯. The TPSA of 82.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 二甲基三硫代碳酸酯. Following Lipinski's Rule of Five, 二甲基三硫代碳酸酯 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 二甲基三硫代碳酸酯?
The CAS number of 二甲基三硫代碳酸酯 is 2314-48-9.
What is the molecular formula of 二甲基三硫代碳酸酯?
The molecular formula of 二甲基三硫代碳酸酯 is C3H6S3.
What is the molecular weight of 二甲基三硫代碳酸酯?
The molecular weight of 二甲基三硫代碳酸酯 is 137.96 g/mol.
Where can I buy 二甲基三硫代碳酸酯?
You can request a quote for 二甲基三硫代碳酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二甲基三硫代碳酸酯?
Yes, KEHONG BIO provides custom synthesis services for 二甲基三硫代碳酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.