Base information
| Cat. No. | |
| CAS No. | 5332-06-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C4H6BrN |
| Molecular Weight | 148.001 |
| Exact Mass | 146.968 |
| XLogP3 | 1.68508 |
| Mr | 28.961 |
| PSA | 23.79 |
| Sequence | - |
| Atom number | 12 |
| Bond number | 11 |
| Ring number | 0 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | BrCCCC#N |
