Base information
| Cat. No. | |
| CAS No. | 69311-70-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H14IN3O7 |
| Molecular Weight | 487.203 |
| Exact Mass | 486.988 |
| XLogP3 | 6.8095 |
| Mr | 111.687 |
| PSA | 146.69 |
| Sequence | - |
| Atom number | 41 |
| Bond number | 42 |
| Ring number | 2 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | [O-][N+](=O)c1cc(ccc1Oc1c(cc(c(c1I)C)[N+](=O)[O-])C(C)C)[N+](=O)[O-] |
