Base information
| Cat. No. | |
| CAS No. | 58-96-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H12N2O6 |
| Molecular Weight | 244.201 |
| Exact Mass | 244.07 |
| XLogP3 | -2.8519 |
| Mr | 54.2691 |
| PSA | 124.78 |
| Sequence | - |
| Atom number | 29 |
| Bond number | 30 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1ccc(=O)[nH]c1=O |
