Base information
| Cat. No. | |
| CAS No. | 1289148-61-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H9BrO |
| Molecular Weight | 213.071 |
| Exact Mass | 211.984 |
| XLogP3 | 2.824 |
| Mr | 49.3025 |
| PSA | 17.07 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 20 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | CCc1ccc(c(c1)Br)C=O |
