Base information
| Cat. No. | |
| CAS No. | 171011-37-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H9BrO2 |
| Molecular Weight | 217.06 |
| Exact Mass | 215.979 |
| XLogP3 | 1.4337 |
| Mr | 46.3976 |
| PSA | 40.46 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 20 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | OCc1cc(Br)ccc1CO |
