Base information
| Cat. No. | |
| CAS No. | 701939-03-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C14H20BrNO3 |
| Molecular Weight | 330.218 |
| Exact Mass | 329.063 |
| XLogP3 | 4.4343 |
| Mr | 78.9557 |
| PSA | 47.56 |
| Sequence | - |
| Atom number | 39 |
| Bond number | 39 |
| Ring number | 1 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | COc1ccc(cc1[C@@H](NC(=O)OC(C)(C)C)C)Br |
