Base information
| Cat. No. | |
| CAS No. | 50907-23-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H5BrN4 |
| Molecular Weight | 225.045 |
| Exact Mass | 223.97 |
| XLogP3 | 1.6292 |
| Mr | 47.3137 |
| PSA | 54.46 |
| Sequence | - |
| Atom number | 17 |
| Bond number | 18 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | Brc1ccc(cc1)c1n[nH]nn1 |
