Base information
| Cat. No. | |
| CAS No. | 2255-80-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H5BrN2S |
| Molecular Weight | 229.097 |
| Exact Mass | 227.936 |
| XLogP3 | 2.7622 |
| Mr | 50.081 |
| PSA | 54.02 |
| Sequence | - |
| Atom number | 16 |
| Bond number | 17 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Cc1ccc(c2c1nsn2)Br |
