Base information
| Cat. No. | |
| CAS No. | 3522-98-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H12BrN |
| Molecular Weight | 178.07 |
| Exact Mass | 177.015 |
| XLogP3 | 2.2129 |
| Mr | 45.1237 |
| PSA | 12.03 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 19 |
| Ring number | 1 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | C=C1CCNCC1.Br |
