Base information
| Cat. No. | |
| CAS No. | 21216-78-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C22H28INO2 |
| Molecular Weight | 465.368 |
| Exact Mass | 465.116 |
| XLogP3 | 0.8964 |
| Mr | 118.871 |
| PSA | 18.46 |
| Sequence | - |
| Atom number | 54 |
| Bond number | 56 |
| Ring number | 4 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | C[N+]1(CCCCC1)CC1COC(O1)(c1ccccc1)c1ccccc1.[I-] |
