Base information
| Cat. No. | |
| CAS No. | 86776-54-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H22FNO2 |
| Molecular Weight | 339.403 |
| Exact Mass | 339.163 |
| XLogP3 | 5.42948 |
| Mr | 96.3235 |
| PSA | 50.09 |
| Sequence | - |
| Atom number | 47 |
| Bond number | 48 |
| Ring number | 2 |
| Rotor number | 9 |
| Residues number | 0 |
| Canonical smiles | CCCCCCCc1ccc(cc1)C(=O)Oc1ccc(c(c1)F)C#N |
