Base information
| Cat. No. | |
| CAS No. | 21161-11-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H5NO6 |
| Molecular Weight | 211.128 |
| Exact Mass | 211.012 |
| XLogP3 | 1.5144 |
| Mr | 49.1826 |
| PSA | 120.42 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 20 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | [O-][N+](=O)c1c(cccc1C(=O)O)C(=O)O |
