Base information
| Cat. No. | |
| CAS No. | 1416438-25-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H9BrClNO |
| Molecular Weight | 262.531 |
| Exact Mass | 260.956 |
| XLogP3 | 3.4241 |
| Mr | 58.3439 |
| PSA | 43.09 |
| Sequence | - |
| Atom number | 22 |
| Bond number | 22 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | ClCCC(=O)c1ccc(cc1N)Br |
