Base information
| Cat. No. | |
| CAS No. | 86718-16-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H14N2O6 |
| Molecular Weight | 282.249 |
| Exact Mass | 282.085 |
| XLogP3 | 2.3347 |
| Mr | 72.1552 |
| PSA | 110.45 |
| Sequence | - |
| Atom number | 34 |
| Bond number | 34 |
| Ring number | 1 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | CCOc1cc(NC(=O)C)c(cc1C(=O)OC)[N+](=O)[O-] |
