Base information
| Cat. No. | |
| CAS No. | 847446-85-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H8F3NO |
| Molecular Weight | 251.204 |
| Exact Mass | 251.056 |
| XLogP3 | 3.5799 |
| Mr | 60.0625 |
| PSA | 29.96 |
| Sequence | - |
| Atom number | 26 |
| Bond number | 27 |
| Ring number | 2 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | O=Cc1ccc(cc1)c1ncccc1C(F)(F)F |