Base information
| Cat. No. | |
| CAS No. | 149550-21-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H10F3NO2 |
| Molecular Weight | 269.219 |
| Exact Mass | 269.066 |
| XLogP3 | 3.17548 |
| Mr | 61.797 |
| PSA | 50.09 |
| Sequence | - |
| Atom number | 29 |
| Bond number | 29 |
| Ring number | 1 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | CCOC(=O)C(=Cc1ccc(cc1)C(F)(F)F)C#N |
