Base information
| Cat. No. | |
| CAS No. | 16883-69-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H12BrNO |
| Molecular Weight | 278.144 |
| Exact Mass | 277.01 |
| XLogP3 | -1.139 |
| Mr | 68.6755 |
| PSA | 20.95 |
| Sequence | - |
| Atom number | 28 |
| Bond number | 28 |
| Ring number | 2 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | O=C(c1ccccc1)C[n+]1ccccc1.[Br-] |
