Base information
| Cat. No. | |
| CAS No. | 1369424-55-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H12BrNO3 |
| Molecular Weight | 250.09 |
| Exact Mass | 249 |
| XLogP3 | 1.4651 |
| Mr | 55.011 |
| PSA | 46.61 |
| Sequence | - |
| Atom number | 25 |
| Bond number | 25 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | CC[C@@H]1COC(=O)N1C(=O)C(Br)C |
