Base information
| Cat. No. | |
| CAS No. | 80826-86-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H9IO |
| Molecular Weight | 248.061 |
| Exact Mass | 247.97 |
| XLogP3 | 2.6136 |
| Mr | 51.114 |
| PSA | 20.23 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 19 |
| Ring number | 1 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Oc1cc(C)c(c(c1)C)I |
