Base information
| Cat. No. | |
| CAS No. | 31755-80-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H7FN2O |
| Molecular Weight | 214.195 |
| Exact Mass | 214.054 |
| XLogP3 | 2.05268 |
| Mr | 57.1717 |
| PSA | 56.65 |
| Sequence | - |
| Atom number | 23 |
| Bond number | 24 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | N#Cc1ccc([nH]c1=O)c1ccc(cc1)F |
