HuagongsheHuagongshe Chemistry Print Report · For research reference only
5-(5-Bromopyridin-3-YL)pyrrolidin-2-one
Identifiers & Physical Properties
| Molecular formula | C9H9BrN2O |
|---|---|
| Average molar mass | 241.08 g/mol |
| SMILES | O=C1CCC(c2cncc(Br)c2)N1 |
| InChIKey | ASQYHAFTYONKOX-UHFFFAOYSA-N |
| PubChem CID | 117667495 |
Chemical & Physical Properties
| XLogP | 0.8 |
|---|---|
| Topological polar surface area | 42 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 2 |
| Rotatable bonds | 1 |
| Heavy atoms | 13 |
| Formal charge | 0 |
| Complexity | 210 |