Base information
| Cat. No. | |
| CAS No. | 1017779-73-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H8FNO |
| Molecular Weight | 165.164 |
| Exact Mass | 165.059 |
| XLogP3 | 1.90038 |
| Mr | 42.414 |
| PSA | 33.02 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 20 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | COc1c(CC#N)cccc1F |
