Base information
| Cat. No. | |
| CAS No. | 149455-89-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H11BrO |
| Molecular Weight | 251.119 |
| Exact Mass | 249.999 |
| XLogP3 | 3.6848 |
| Mr | 61.6675 |
| PSA | 17.07 |
| Sequence | - |
| Atom number | 25 |
| Bond number | 26 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Brc1ccc2c(c1)C=CC(C2=O)(C)C |
