Base information
| Cat. No. | |
| CAS No. | 133647-95-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H20INO2 |
| Molecular Weight | 385.24 |
| Exact Mass | 385.054 |
| XLogP3 | 2.9684 |
| Mr | 91.256 |
| PSA | 29.54 |
| Sequence | - |
| Atom number | 40 |
| Bond number | 42 |
| Ring number | 3 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | COC(=O)[C@@H]1[C@H]2CC[C@H](N2C)C[C@@H]1c1ccc(cc1)I |
