Base information
| Cat. No. | |
| CAS No. | 21865-50-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H12BrN |
| Molecular Weight | 250.134 |
| Exact Mass | 249.015 |
| XLogP3 | 3.8092 |
| Mr | 63.4307 |
| PSA | 15.79 |
| Sequence | - |
| Atom number | 26 |
| Bond number | 28 |
| Ring number | 3 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Brc1ccc2c(c1)c1CCCCc1[nH]2 |
