Base information
| Cat. No. | |
| CAS No. | 588679-98-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H11N3O4 |
| Molecular Weight | 225.201 |
| Exact Mass | 225.075 |
| XLogP3 | 1.8863 |
| Mr | 57.2381 |
| PSA | 110.17 |
| Sequence | - |
| Atom number | 27 |
| Bond number | 27 |
| Ring number | 1 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | NNC(=O)COc1ccc(c(c1)C)[N+](=O)[O-] |
