Base information
| Cat. No. | |
| CAS No. | 201677-59-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H16BrNO3 |
| Molecular Weight | 350.207 |
| Exact Mass | 349.031 |
| XLogP3 | 3.9711 |
| Mr | 86.1205 |
| PSA | 58.56 |
| Sequence | - |
| Atom number | 37 |
| Bond number | 38 |
| Ring number | 2 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | O=CNc1cc(ccc1OCc1ccccc1)[C@H](CBr)O |
