TL;DR: Endothion (CAS 2778-04-3) is a chemical compound with molecular formula C9H13O6PS and molecular weight 280.01706 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(dimethoxyphosphorylsulfanylmethyl)-5-methoxypyran-4-one
Also Known As: ENDOTHION, Endocide, Endocid, Phosphopyron, Phosphopyrone
Top 5 of 14 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C9H13O6PS |
| Molecular Weight | 280.01706 g/mol |
| XLogP | -0.2 |
| Topological Polar Surface Area (TPSA) | 96.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 280.01706 Da |
| Heavy Atoms | 17 |
| Complexity | 394.0 |
| Melting Point | 194 to 205 °F (EPA, 1998) |
| Vapor Pressure | 0.00000569 [mmHg] |
| Solubility | In water, 1.5X10+6 mg/L |
| SMILES | COC1=COC(=CC1=O)CSP(=O)(OC)OC |
| InChIKey | YCAGGFXSFQFVQL-UHFFFAOYSA-N |
The XLogP value of -0.2 indicates that Endothion is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 96.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Endothion. Following Lipinski's Rule of Five, Endothion has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Endothion is 2778-04-3.
The molecular formula of Endothion is C9H13O6PS.
The molecular weight of Endothion is 280.01706 g/mol.
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