Base information
| Cat. No. | |
| CAS No. | 1044148-31-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H16BrNO2 |
| Molecular Weight | 250.133 |
| Exact Mass | 249.036 |
| XLogP3 | -3.3015 |
| Mr | 58.0768 |
| PSA | 29.46 |
| Sequence | - |
| Atom number | 29 |
| Bond number | 30 |
| Ring number | 3 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | O[C@@H]1[C@H]2O[C@H]3C[C@@H]1[N+]([C@@H]2C3)(C)C.[Br-] |
