Base information
| Cat. No. | |
| CAS No. | 1209335-53-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H7BrClNO |
| Molecular Weight | 224.483 |
| Exact Mass | 222.94 |
| XLogP3 | 2.6547 |
| Mr | 45.394 |
| PSA | 22.12 |
| Sequence | - |
| Atom number | 17 |
| Bond number | 16 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | COc1cnccc1Br.Cl |
