Base information
| Cat. No. | |
| CAS No. | 4598-86-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C5H5N3O4 |
| Molecular Weight | 171.111 |
| Exact Mass | 171.028 |
| XLogP3 | 0.5497 |
| Mr | 39.2703 |
| PSA | 100.94 |
| Sequence | - |
| Atom number | 17 |
| Bond number | 17 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | Cn1nc(c(c1)[N+](=O)[O-])C(=O)O |
