Base information
| Cat. No. | |
| CAS No. | 4559-96-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C10H10BrClO |
| Molecular Weight | 261.543 |
| Exact Mass | 259.96 |
| XLogP3 | 3.6508 |
| Mr | 58.7465 |
| PSA | 17.07 |
| Sequence | - |
| Atom number | 23 |
| Bond number | 23 |
| Ring number | 1 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | ClCCCC(=O)c1ccc(cc1)Br |
