Base information
| Cat. No. | |
| CAS No. | 1227574-71-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H4F3NO2 |
| Molecular Weight | 179.097 |
| Exact Mass | 179.019 |
| XLogP3 | 1.0993 |
| Mr | 34.0877 |
| PSA | 53.09 |
| Sequence | - |
| Atom number | 16 |
| Bond number | 16 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | O=c1[nH]cc(cc1O)C(F)(F)F |
