Base information
| Cat. No. | |
| CAS No. | 1403764-97-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H7BrClNO |
| Molecular Weight | 236.494 |
| Exact Mass | 234.94 |
| XLogP3 | 2.8145 |
| Mr | 48.405 |
| PSA | 22.12 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 18 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | COc1c(C)cc(nc1Cl)Br |
