Base information
| Cat. No. | |
| CAS No. | 1211531-67-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H9BrClNO |
| Molecular Weight | 250.52 |
| Exact Mass | 248.956 |
| XLogP3 | 3.2847 |
| Mr | 53.053 |
| PSA | 22.12 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 21 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | CC(Oc1ncc(cc1Cl)Br)C |
