Base information
| Cat. No. | |
| CAS No. | 85547-11-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H31I |
| Molecular Weight | 410.375 |
| Exact Mass | 410.147 |
| XLogP3 | 7.1715 |
| Mr | 107.195 |
| PSA | 0 |
| Sequence | - |
| Atom number | 53 |
| Bond number | 55 |
| Ring number | 3 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | CCC[C@@H]1CC[C@H](CC1)[C@@H]1CCC(CC1)c1ccc(cc1)I |
