Base information
| Cat. No. | |
| CAS No. | 1197357-94-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H6F3IO2 |
| Molecular Weight | 330.042 |
| Exact Mass | 329.936 |
| XLogP3 | 3.0966 |
| Mr | 55.4405 |
| PSA | 26.3 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 21 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | COC(=O)c1ccc(c(c1)I)C(F)(F)F |
