HuagongsheHuagongshe Chemistry Print Report · For research reference only
3-Ethylsulfonylquinoline
Identifiers & Physical Properties
| Molecular formula | C11H11NO2S |
|---|---|
| Average molar mass | 221.28 g/mol |
| Monoisotopic mass | 221.05104977 g/mol |
| SMILES | CCS(=O)(=O)c1cnc2ccccc2c1 |
| InChIKey | RTUJUKZOWFLUFU-UHFFFAOYSA-N |
| PubChem CID | 12378950 |
Chemical & Physical Properties
| XLogP | 2.2 |
|---|---|
| Topological polar surface area | 55.4 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 3 |
| Rotatable bonds | 2 |
| Heavy atoms | 15 |
| Formal charge | 0 |
| Complexity | 307 |