Base information
| Cat. No. | |
| CAS No. | 3621-38-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C20H20INO4 |
| Molecular Weight | 465.282 |
| Exact Mass | 465.044 |
| XLogP3 | 0.0858 |
| Mr | 111.346 |
| PSA | 51.8 |
| Sequence | - |
| Atom number | 46 |
| Bond number | 48 |
| Ring number | 4 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | COc1cc2-c3cc4ccc(c(c4c[n+]3CCc2cc1O)OC)OC.[I-] |
