Base information
| Cat. No. | |
| CAS No. | 100-12-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H9NO2 |
| Molecular Weight | 151.163 |
| Exact Mass | 151.063 |
| XLogP3 | 2.6804 |
| Mr | 45.037 |
| PSA | 45.82 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 20 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | CCc1ccc(cc1)[N+](=O)[O-] |
