Base information
| Cat. No. | |
| CAS No. | 161957-62-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H6BrClO |
| Molecular Weight | 233.49 |
| Exact Mass | 231.929 |
| XLogP3 | 3.3051 |
| Mr | 49.3465 |
| PSA | 17.07 |
| Sequence | - |
| Atom number | 17 |
| Bond number | 17 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | CC(=O)c1cccc(c1Cl)Br |
