Base information
| Cat. No. | |
| CAS No. | 2551-76-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C22H30INO |
| Molecular Weight | 451.384 |
| Exact Mass | 451.137 |
| XLogP3 | 2.1163 |
| Mr | 118.347 |
| PSA | 9.23 |
| Sequence | - |
| Atom number | 55 |
| Bond number | 55 |
| Ring number | 2 |
| Rotor number | 9 |
| Residues number | 0 |
| Canonical smiles | CC[N+](CCOc1ccc(cc1)/C=C/c1ccccc1)(CC)CC.[I-] |
