Base information
| Cat. No. | |
| CAS No. | 116057-75-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C28H30INO |
| Molecular Weight | 523.448 |
| Exact Mass | 523.137 |
| XLogP3 | 7.0728 |
| Mr | 143.854 |
| PSA | 12.47 |
| Sequence | - |
| Atom number | 61 |
| Bond number | 64 |
| Ring number | 4 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | CC/C(=C(\c1ccc(cc1)I)/c1ccc(cc1)OCCN1CCCC1)/c1ccccc1 |
