Base information
| Cat. No. | |
| CAS No. | 130133-53-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H6N2O3 |
| Molecular Weight | 166.134 |
| Exact Mass | 166.038 |
| XLogP3 | 2.0939 |
| Mr | 45.0559 |
| PSA | 88.91 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 18 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | O=Cc1c(N)cccc1[N+](=O)[O-] |
