Base information
| Cat. No. | |
| CAS No. | 1002726-59-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H9N3O4 |
| Molecular Weight | 223.185 |
| Exact Mass | 223.059 |
| XLogP3 | 1.7605 |
| Mr | 59.5297 |
| PSA | 97.04 |
| Sequence | - |
| Atom number | 25 |
| Bond number | 26 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | O=C1Nc2nc(ccc2OC1(C)C)[N+](=O)[O-] |
