Base information
| Cat. No. | |
| CAS No. | 140658-45-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C19H18N2O12 |
| Molecular Weight | 466.352 |
| Exact Mass | 466.086 |
| XLogP3 | 3.8109 |
| Mr | 113.108 |
| PSA | 203.16 |
| Sequence | - |
| Atom number | 51 |
| Bond number | 52 |
| Ring number | 2 |
| Rotor number | 12 |
| Residues number | 0 |
| Canonical smiles | COc1cc(C(=O)O)c(cc1OCCCOc1cc([N+](=O)[O-])c(cc1OC)C(=O)O)[N+](=O)[O-] |
