Base information
| Cat. No. | |
| CAS No. | 181585-93-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C5H5N3O4 |
| Molecular Weight | 171.111 |
| Exact Mass | 171.028 |
| XLogP3 | 0.6277 |
| Mr | 38.6892 |
| PSA | 100.8 |
| Sequence | - |
| Atom number | 17 |
| Bond number | 17 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | [O-][N+](=O)c1cc(n[nH]1)C(=O)OC |
