Base information
| Cat. No. | |
| CAS No. | 741737-19-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H8F3N3O |
| Molecular Weight | 219.164 |
| Exact Mass | 219.062 |
| XLogP3 | 0.7632 |
| Mr | 49.2014 |
| PSA | 57.78 |
| Sequence | - |
| Atom number | 23 |
| Bond number | 24 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | O=c1[nH]c(nc2c1CNCC2)C(F)(F)F |
