Base information
| Cat. No. | |
| CAS No. | 207591-86-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H12N2O5 |
| Molecular Weight | 228.202 |
| Exact Mass | 228.075 |
| XLogP3 | 1.7084 |
| Mr | 57.371 |
| PSA | 118.37 |
| Sequence | - |
| Atom number | 28 |
| Bond number | 27 |
| Ring number | 1 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | OC(=O)[C@H](Cc1ccc(cc1)[N+](=O)[O-])N.O |
