Base information
| Cat. No. | |
| CAS No. | 70580-87-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H12N6O4 |
| Molecular Weight | 268.229 |
| Exact Mass | 268.092 |
| XLogP3 | -1.21104 |
| Mr | 59.507 |
| PSA | 160.35 |
| Sequence | - |
| Atom number | 31 |
| Bond number | 32 |
| Ring number | 2 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | OC[C@H]1O[C@H]([C@@H]([C@@H]1N=[N+]=[N-])O)n1ccc(nc1=O)N |
