Base information
| Cat. No. | |
| CAS No. | 1153-85-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C18H12BrN |
| Molecular Weight | 322.199 |
| Exact Mass | 321.015 |
| XLogP3 | 5.5462 |
| Mr | 88.481 |
| PSA | 4.93 |
| Sequence | - |
| Atom number | 32 |
| Bond number | 35 |
| Ring number | 4 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | Brc1ccc2c(c1)c1ccccc1n2c1ccccc1 |
