Base information
| Cat. No. | |
| CAS No. | 13682-18-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H7N3O2 |
| Molecular Weight | 189.171 |
| Exact Mass | 189.054 |
| XLogP3 | 2.5081 |
| Mr | 52.8457 |
| PSA | 74.5 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 22 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | [O-][N+](=O)c1cccc(c1)c1ncc[nH]1 |
