Base information
| Cat. No. | |
| CAS No. | 850544-21-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H7N3O4 |
| Molecular Weight | 197.148 |
| Exact Mass | 197.044 |
| XLogP3 | 1.463 |
| Mr | 48.7429 |
| PSA | 111.03 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 21 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | COC(=O)c1ncc(c(c1)N)[N+](=O)[O-] |
