Base information
| Cat. No. | |
| CAS No. | 1240518-41-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H5F2NO |
| Molecular Weight | 169.128 |
| Exact Mass | 169.034 |
| XLogP3 | 1.84508 |
| Mr | 37.565 |
| PSA | 33.02 |
| Sequence | - |
| Atom number | 17 |
| Bond number | 17 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | COc1cc(F)cc(c1C#N)F |
