Base information
| Cat. No. | |
| CAS No. | 1369775-86-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C10H13BrO |
| Molecular Weight | 229.114 |
| Exact Mass | 228.015 |
| XLogP3 | 3.5811 |
| Mr | 55.214 |
| PSA | 9.23 |
| Sequence | - |
| Atom number | 25 |
| Bond number | 25 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | COc1cc(Br)ccc1C(C)C |
