Base information
| Cat. No. | |
| CAS No. | 68890-19-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H12BrNO |
| Molecular Weight | 266.134 |
| Exact Mass | 265.01 |
| XLogP3 | 3.5709 |
| Mr | 65.0947 |
| PSA | 29.1 |
| Sequence | - |
| Atom number | 27 |
| Bond number | 28 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | O=C1CCCC(=C1)Nc1ccccc1Br |
