Base information
| Cat. No. | |
| CAS No. | 66985-17-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C20H32BrNO4 |
| Molecular Weight | 430.376 |
| Exact Mass | 429.151 |
| XLogP3 | -0.2474 |
| Mr | 111.961 |
| PSA | 55.76 |
| Sequence | - |
| Atom number | 58 |
| Bond number | 58 |
| Ring number | 3 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | OCC(c1ccccc1)C(=O)O[C@@H]1C[C@@H]2CC[C@H](C1)[N+]2(C)C(C)C.[Br-].O |
