Base information
| Cat. No. | |
| CAS No. | 21857-41-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C10H11NO5 |
| Molecular Weight | 225.198 |
| Exact Mass | 225.064 |
| XLogP3 | 1.8421 |
| Mr | 57.621 |
| PSA | 81.35 |
| Sequence | - |
| Atom number | 27 |
| Bond number | 27 |
| Ring number | 1 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | COC(=O)Cc1cc(OC)ccc1[N+](=O)[O-] |