Base information
| Cat. No. | |
| CAS No. | 1360900-71-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H6BrNO2 |
| Molecular Weight | 228.043 |
| Exact Mass | 226.958 |
| XLogP3 | 1.7873 |
| Mr | 51.4577 |
| PSA | 49.33 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 19 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | O=C1Cc2c(N1)c(Br)cc(c2)O |
