Base information
| Cat. No. | |
| CAS No. | 76041-72-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H4F3NS |
| Molecular Weight | 179.163 |
| Exact Mass | 179.002 |
| XLogP3 | 2.763 |
| Mr | 36.6287 |
| PSA | 47.88 |
| Sequence | - |
| Atom number | 15 |
| Bond number | 15 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | S=c1ccc(c[nH]1)C(F)(F)F |
