Base information
| Cat. No. | |
| CAS No. | 21085-72-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H17BrO9 |
| Molecular Weight | 397.173 |
| Exact Mass | 396.006 |
| XLogP3 | 0.0743 |
| Mr | 76.586 |
| PSA | 114.43 |
| Sequence | - |
| Atom number | 40 |
| Bond number | 40 |
| Ring number | 1 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | COC(=O)[C@H]1O[C@H](Br)[C@@H]([C@H]([C@@H]1OC(=O)C)OC(=O)C)OC(=O)C |
