Base information
| Cat. No. | |
| CAS No. | 1454700-89-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C17H21BrO2 |
| Molecular Weight | 337.251 |
| Exact Mass | 336.072 |
| XLogP3 | 4.2553 |
| Mr | 84.3555 |
| PSA | 26.3 |
| Sequence | - |
| Atom number | 41 |
| Bond number | 43 |
| Ring number | 3 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | CO[C@@H]1[C@@H](C)C[C@@]2(C[C@H]1C)Cc1c(C2=O)cc(cc1)Br |
