Base information
| Cat. No. | |
| CAS No. | 536-20-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H5NO6 |
| Molecular Weight | 211.128 |
| Exact Mass | 211.012 |
| XLogP3 | 0.1762 |
| Mr | 45.1149 |
| PSA | 124.79 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 20 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | OC(=O)c1cc(nc(c1)C(=O)O)C(=O)O |
