Base information
| Cat. No. | |
| CAS No. | 172901-00-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H19BrO |
| Molecular Weight | 271.193 |
| Exact Mass | 270.062 |
| XLogP3 | 3.8703 |
| Mr | 69.205 |
| PSA | 9.23 |
| Sequence | - |
| Atom number | 34 |
| Bond number | 34 |
| Ring number | 1 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | BrC[C@@H](C(C)C)COCc1ccccc1 |
