Base information
| Cat. No. | |
| CAS No. | 5000-66-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H6BrClO |
| Molecular Weight | 233.49 |
| Exact Mass | 231.929 |
| XLogP3 | 2.9176 |
| Mr | 49.5165 |
| PSA | 17.07 |
| Sequence | - |
| Atom number | 17 |
| Bond number | 17 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | BrCC(=O)c1ccccc1Cl |
