Base information
| Cat. No. | |
| CAS No. | 2204-96-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H16BrN |
| Molecular Weight | 254.166 |
| Exact Mass | 253.047 |
| XLogP3 | 4.3394 |
| Mr | 63.7364 |
| PSA | 26.02 |
| Sequence | - |
| Atom number | 30 |
| Bond number | 31 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | NC(c1ccc(cc1)Br)C1CCCC1 |
