Base information
| Cat. No. | |
| CAS No. | 1260672-33-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H9BrN2O2 |
| Molecular Weight | 233.063 |
| Exact Mass | 231.985 |
| XLogP3 | 1.3593 |
| Mr | 47.2755 |
| PSA | 44.12 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 21 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | Cn1cc(nc1C(=O)OCC)Br |
