Base information
| Cat. No. | |
| CAS No. | 1211584-44-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H6FNO |
| Molecular Weight | 127.116 |
| Exact Mass | 127.043 |
| XLogP3 | 1.2347 |
| Mr | 31.184 |
| PSA | 33.12 |
| Sequence | - |
| Atom number | 15 |
| Bond number | 15 |
| Ring number | 1 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Oc1cnc(c(c1)F)C |
