HuagongsheHuagongshe Chemistry Print Report · For research reference only
5-Bromo-1-(2-nitrophenyl)-2,3-dihydro-1H-indole

Identifiers & Physical Properties
| CAS No. | 96014-84-5 |
|---|---|
| Molecular formula | C14H11BrN2O2 |
| Average molar mass | 319.15 g/mol |
| Monoisotopic mass | 318.00038969 g/mol |
| SMILES | O=[N+]([O-])c1ccccc1N1CCc2cc(Br)ccc21 |
| InChIKey | QMPJBHNXGPLERE-UHFFFAOYSA-N |
| PubChem CID | 13823332 |
| DTXSID | DTXSID20550517 |
Chemical & Physical Properties
| XLogP | 4.2 |
|---|---|
| Topological polar surface area | 49.1 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 3 |
| Rotatable bonds | 1 |
| Heavy atoms | 19 |
| Formal charge | 0 |
| Complexity | 347 |