Base information
| Cat. No. | |
| CAS No. | 1516-58-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H4N4O2 |
| Molecular Weight | 164.122 |
| Exact Mass | 164.033 |
| XLogP3 | 2.51256 |
| Mr | 40.802 |
| PSA | 95.57 |
| Sequence | - |
| Atom number | 16 |
| Bond number | 16 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | N#[N+][N-]c1ccccc1[N+](=O)[O-] |