Base information
| Cat. No. | |
| CAS No. | 31181-53-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H6FN |
| Molecular Weight | 111.117 |
| Exact Mass | 111.048 |
| XLogP3 | 1.5291 |
| Mr | 29.161 |
| PSA | 12.89 |
| Sequence | - |
| Atom number | 14 |
| Bond number | 14 |
| Ring number | 1 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Cc1ccc(cn1)F |
