Base information
| Cat. No. | |
| CAS No. | 84249-14-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C5H5BrN2 |
| Molecular Weight | 173.011 |
| Exact Mass | 171.964 |
| XLogP3 | 2.0075 |
| Mr | 36.3414 |
| PSA | 38.91 |
| Sequence | - |
| Atom number | 13 |
| Bond number | 13 |
| Ring number | 1 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Brc1ccnc(c1)N |
