Base information
| Cat. No. | |
| CAS No. | 1046861-62-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H10BBrO2 |
| Molecular Weight | 228.879 |
| Exact Mass | 227.996 |
| XLogP3 | 0.6913 |
| Mr | 53.7406 |
| PSA | 40.46 |
| Sequence | - |
| Atom number | 22 |
| Bond number | 22 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | CCc1cc(Br)ccc1B(O)O |
