HuagongsheHuagongshe Chemistry Print Report · For research reference only
2-Fluoro-1-(4-methoxyphenyl)-2-(2-pyridinylsulfonyl)ethanone
Identifiers & Physical Properties
| CAS No. | 1365765-67-8 |
|---|---|
| Molecular formula | C14H12FNO4S |
| Average molar mass | 309.31 g/mol |
| Monoisotopic mass | 309.0471072 g/mol |
| SMILES | COc1ccc(C(=O)C(F)S(=O)(=O)c2ccccn2)cc1 |
| InChIKey | ZVBBXLTWDFNKGV-UHFFFAOYSA-N |
| PubChem CID | 135073716 |
| DTXSID | DTXSID001184156 |
Chemical & Physical Properties
| XLogP | 2.3 |
|---|---|
| Topological polar surface area | 81.7 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 6 |
| Rotatable bonds | 5 |
| Heavy atoms | 21 |
| Formal charge | 0 |
| Complexity | 454 |