Base information
| Cat. No. | |
| CAS No. | 63996-36-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H8BrN |
| Molecular Weight | 234.092 |
| Exact Mass | 232.984 |
| XLogP3 | 3.5111 |
| Mr | 57.373 |
| PSA | 12.89 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 22 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | Brc1ccc(cc1)c1ccccn1 |
