Base information
| Cat. No. | |
| CAS No. | 587-46-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C15H17BrN2O2 |
| Molecular Weight | 337.212 |
| Exact Mass | 336.047 |
| XLogP3 | -0.9132 |
| Mr | 83.038 |
| PSA | 33.42 |
| Sequence | - |
| Atom number | 37 |
| Bond number | 37 |
| Ring number | 2 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | O=C(N(C)C)Oc1ccc[n+](c1)Cc1ccccc1.[Br-] |