Base information
| Cat. No. | |
| CAS No. | 141187-98-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H5F3N2O |
| Molecular Weight | 178.112 |
| Exact Mass | 178.035 |
| XLogP3 | 1.5571 |
| Mr | 36.4691 |
| PSA | 58.88 |
| Sequence | - |
| Atom number | 17 |
| Bond number | 17 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | Nc1cc(cc(=O)[nH]1)C(F)(F)F |
