Base information
| Cat. No. | |
| CAS No. | 5414-21-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C5H8BrN |
| Molecular Weight | 162.028 |
| Exact Mass | 160.984 |
| XLogP3 | 2.07518 |
| Mr | 33.768 |
| PSA | 23.79 |
| Sequence | - |
| Atom number | 15 |
| Bond number | 14 |
| Ring number | 0 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | BrCCCCC#N |
