Base information
| Cat. No. | |
| CAS No. | 4097-63-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H6N2O6 |
| Molecular Weight | 214.132 |
| Exact Mass | 214.023 |
| XLogP3 | 2.2636 |
| Mr | 52.601 |
| PSA | 121.1 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 21 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | COc1cc(cc(c1O)[N+](=O)[O-])[N+](=O)[O-] |
