Base information
| Cat. No. | |
| CAS No. | 85750-24-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H9BrN2 |
| Molecular Weight | 273.128 |
| Exact Mass | 271.995 |
| XLogP3 | 3.49958 |
| Mr | 65.946 |
| PSA | 36.68 |
| Sequence | - |
| Atom number | 25 |
| Bond number | 26 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | N#CC(c1ccccn1)c1ccc(cc1)Br |
