Base information
| Cat. No. | |
| CAS No. | 139591-03-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H9F3N2 |
| Molecular Weight | 226.198 |
| Exact Mass | 226.072 |
| XLogP3 | 3.2411 |
| Mr | 55.137 |
| PSA | 17.82 |
| Sequence | - |
| Atom number | 25 |
| Bond number | 26 |
| Ring number | 2 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | C=CCn1c2ccccc2nc1C(F)(F)F |
