Base information
| Cat. No. | |
| CAS No. | 1590-25-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H9BrO |
| Molecular Weight | 249.103 |
| Exact Mass | 247.984 |
| XLogP3 | 3.8049 |
| Mr | 61.8425 |
| PSA | 17.07 |
| Sequence | - |
| Atom number | 23 |
| Bond number | 24 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | Brc1ccc2c(c1)ccc(c2)C(=O)C |
