Base information
| Cat. No. | |
| CAS No. | 1048914-02-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H5F3N2 |
| Molecular Weight | 186.134 |
| Exact Mass | 186.04 |
| XLogP3 | 2.2451 |
| Mr | 41.5784 |
| PSA | 38.91 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 18 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | C#Cc1cc(cnc1N)C(F)(F)F |
