Base information
| Cat. No. | |
| CAS No. | 1213923-02-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H9BrClNO |
| Molecular Weight | 250.52 |
| Exact Mass | 248.956 |
| XLogP3 | 2.7949 |
| Mr | 52.7942 |
| PSA | 46.25 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 21 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | OC[C@@H](c1ccc(cc1Br)Cl)N |