Base information
| Cat. No. | |
| CAS No. | 17200-53-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C4H4BrN |
| Molecular Weight | 145.985 |
| Exact Mass | 144.953 |
| XLogP3 | 1.46108 |
| Mr | 28.487 |
| PSA | 23.79 |
| Sequence | - |
| Atom number | 10 |
| Bond number | 9 |
| Ring number | 0 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | BrCC(=C)C#N |
