Base information
| Cat. No. | |
| CAS No. | 288246-16-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C4H2BrN3 |
| Molecular Weight | 171.983 |
| Exact Mass | 170.943 |
| XLogP3 | 1.04388 |
| Mr | 31.0027 |
| PSA | 52.47 |
| Sequence | - |
| Atom number | 10 |
| Bond number | 10 |
| Ring number | 1 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Brc1c[nH]nc1C#N |
