Base information
| Cat. No. | |
| CAS No. | 57774-35-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H8BrN |
| Molecular Weight | 258.113 |
| Exact Mass | 256.984 |
| XLogP3 | 3.98778 |
| Mr | 64.293 |
| PSA | 23.79 |
| Sequence | - |
| Atom number | 23 |
| Bond number | 24 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | N#Cc1ccc(cc1)c1ccc(cc1)Br |
