Base information
| Cat. No. | |
| CAS No. | 3538-57-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H28BrFO2 |
| Molecular Weight | 411.348 |
| Exact Mass | 410.126 |
| XLogP3 | 5.189 |
| Mr | 101.97 |
| PSA | 34.14 |
| Sequence | - |
| Atom number | 53 |
| Bond number | 56 |
| Ring number | 4 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | O=C1CC[C@]2(C(=C1)[C@@H](F)C[C@@H]1[C@@H]2CC[C@]2([C@H]1CC[C@]2(Br)C(=O)C)C)C |
