Base information
| Cat. No. | |
| CAS No. | 189999-35-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H8F3IO3S |
| Molecular Weight | 428.165 |
| Exact Mass | 427.919 |
| XLogP3 | 0.9276 |
| Mr | 79.0884 |
| PSA | 65.58 |
| Sequence | - |
| Atom number | 29 |
| Bond number | 30 |
| Ring number | 3 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | c1ccc2-c3c([I+]c2c1)cccc3.FC(S(=O)(=O)[O-])(F)F |
