Base information
| Cat. No. | |
| CAS No. | 299202-82-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H9NO5 |
| Molecular Weight | 247.204 |
| Exact Mass | 247.048 |
| XLogP3 | 3.1991 |
| Mr | 64.8455 |
| PSA | 85.26 |
| Sequence | - |
| Atom number | 27 |
| Bond number | 28 |
| Ring number | 2 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | COc1cc(ccc1c1ccc(o1)C=O)[N+](=O)[O-] |
