Base information
| Cat. No. | |
| CAS No. | 57781-15-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H25BrF2O5 |
| Molecular Weight | 475.321 |
| Exact Mass | 474.085 |
| XLogP3 | 2.3203 |
| Mr | 105.07 |
| PSA | 94.83 |
| Sequence | - |
| Atom number | 54 |
| Bond number | 57 |
| Ring number | 4 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | OCC(=O)[C@@]1(O)CC[C@@H]2[C@]1(C)C[C@H](O)[C@]1([C@H]2C[C@H](C2=CC(=O)C(=C[C@]12C)Br)F)F |
