Base information
| Cat. No. | |
| CAS No. | 19404-40-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H6N4O4 |
| Molecular Weight | 198.136 |
| Exact Mass | 198.039 |
| XLogP3 | 2.0591 |
| Mr | 51.1867 |
| PSA | 116.56 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 20 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | CNc1ncc(cc1[N+](=O)[O-])[N+](=O)[O-] |
