Base information
| Cat. No. | |
| CAS No. | 159651-91-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H22INO |
| Molecular Weight | 371.256 |
| Exact Mass | 371.075 |
| XLogP3 | 3.9102 |
| Mr | 90.124 |
| PSA | 23.47 |
| Sequence | - |
| Atom number | 41 |
| Bond number | 42 |
| Ring number | 2 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | I/C=C/CN(C1CCc2c(C1)c(O)ccc2)CCC |
