Base information
| Cat. No. | |
| CAS No. | 71682-97-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H5F2NO |
| Molecular Weight | 181.139 |
| Exact Mass | 181.034 |
| XLogP3 | 2.06118 |
| Mr | 41.1085 |
| PSA | 40.86 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 18 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | N#CCC(=O)c1ccc(c(c1)F)F |
