Base information
| Cat. No. | |
| CAS No. | 474554-45-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H11FN2O2 |
| Molecular Weight | 234.226 |
| Exact Mass | 234.08 |
| XLogP3 | 2.36646 |
| Mr | 58.428 |
| PSA | 66.04 |
| Sequence | - |
| Atom number | 28 |
| Bond number | 28 |
| Ring number | 1 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | CCOc1cc(C#N)c(c(c1OCC)F)C#N |
