Base information
| Cat. No. | |
| CAS No. | 52928-01-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H5IS |
| Molecular Weight | 236.073 |
| Exact Mass | 235.916 |
| XLogP3 | 2.5799 |
| Mr | 46.411 |
| PSA | 38.8 |
| Sequence | - |
| Atom number | 13 |
| Bond number | 13 |
| Ring number | 1 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Sc1ccc(cc1)I |
