Base information
| Cat. No. | |
| CAS No. | 80336-64-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H17BrO |
| Molecular Weight | 269.177 |
| Exact Mass | 268.046 |
| XLogP3 | 3.8512 |
| Mr | 68.7005 |
| PSA | 17.07 |
| Sequence | - |
| Atom number | 32 |
| Bond number | 32 |
| Ring number | 1 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | CC(Cc1ccc(cc1)C(=O)C(Br)C)C |
