Base information
| Cat. No. | |
| CAS No. | 66069-40-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H9N5O11 |
| Molecular Weight | 447.27 |
| Exact Mass | 447.03 |
| XLogP3 | 4.6347 |
| Mr | 111.14 |
| PSA | 242.17 |
| Sequence | - |
| Atom number | 41 |
| Bond number | 43 |
| Ring number | 3 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | OC(=O)C(ON=C1c2cc(cc(c2-c2c1cc(cc2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])C |
