土菌灵
TL;DR: 土菌灵 (CAS 2593-15-9) is a chemical compound with molecular formula C5H5Cl3N2OS and molecular weight 245.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
土菌灵
5-ethoxy-3-(trichloromethyl)-1,2,4-thiadiazole
Also Known As: Etridiazole, Echlomezole, Ethazol, Echlomezol, Koban
| Molecular Formula | C5H5Cl3N2OS |
|---|---|
| Molecular Weight | 245.92 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 63.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 245.91882 |
| Heavy Atoms | 12 |
| Complexity | 154.0 |
| Melting Point | 22 °C |
| Boiling Point | 95 °C at 1 mm Hg |
| Density | 1.497 at 25 °C |
| Solubility | SOL IN ACETONE, ETHER, ETHANOL, XYLENE, CARBON TETRACHLORIDE |
| Flash Point | 154.5 °C (open cup) |
| Vapor Pressure | 0.0001 [mmHg] |
| Refractive Index | 1.5341 at 20 °C |
Chemical Identifiers
| CAS Number | 2593-15-9 |
|---|---|
| SMILES | CCOC1=NC(=NS1)C(Cl)(Cl)Cl |
| InChIKey | KQTVWCSONPJJPE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
土菌灵 (CAS 2593-15-9), with molecular formula C5H5Cl3N2OS and molecular weight 245.92 g/mol. IUPAC: 5-ethoxy-3-(trichloromethyl)-1,2,4-thiadiazole.
Chemical Property Profile of 土菌灵
Property Insights of 土菌灵
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 土菌灵. The TPSA of 63.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 土菌灵. Following Lipinski's Rule of Five, 土菌灵 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 土菌灵?
The CAS number of 土菌灵 is 2593-15-9.
What is the molecular formula of 土菌灵?
The molecular formula of 土菌灵 is C5H5Cl3N2OS.
What is the molecular weight of 土菌灵?
The molecular weight of 土菌灵 is 245.92 g/mol.
Where can I buy 土菌灵?
You can request a quote for 土菌灵 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 土菌灵?
Yes, KEHONG BIO provides custom synthesis services for 土菌灵 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.