Base information
| Cat. No. | |
| CAS No. | 54723-08-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H5N3O3 |
| Molecular Weight | 191.144 |
| Exact Mass | 191.033 |
| XLogP3 | 1.98308 |
| Mr | 46.8973 |
| PSA | 102.2 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 19 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | N#CN=[N+](c1ccc(cc1)C(=O)O)[O-] |
