Base information
| Cat. No. | |
| CAS No. | 2068151-92-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H6BrClN2O |
| Molecular Weight | 237.482 |
| Exact Mass | 235.935 |
| XLogP3 | 1.6511 |
| Mr | 46.5635 |
| PSA | 34.89 |
| Sequence | - |
| Atom number | 17 |
| Bond number | 17 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | Cn1cc(c(n1)C(=O)CBr)Cl |