HuagongsheHuagongshe Chemistry Print Report · For research reference only
2-(4-Bromophenyl)-1-(methylsulfonyl)azetidine
Identifiers & Physical Properties
| Molecular formula | C10H12BrNO2S |
|---|---|
| Average molar mass | 290.18 g/mol |
| Monoisotopic mass | 288.97721 g/mol |
| SMILES | CS(=O)(=O)N1CCC1c1ccc(Br)cc1 |
| InChIKey | SMVIJSFJMWNQFD-UHFFFAOYSA-N |
| PubChem CID | 86698677 |
Chemical & Physical Properties
| XLogP | 1.9 |
|---|---|
| Topological polar surface area | 45.8 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 3 |
| Rotatable bonds | 2 |
| Heavy atoms | 15 |
| Formal charge | 0 |
| Complexity | 317 |