Base information
| Cat. No. | |
| CAS No. | 702641-07-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H5F3IN |
| Molecular Weight | 311.042 |
| Exact Mass | 310.942 |
| XLogP3 | 3.37608 |
| Mr | 53.683 |
| PSA | 23.79 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 19 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | N#CCc1cc(ccc1I)C(F)(F)F |
