Base information
| Cat. No. | |
| CAS No. | 1072952-05-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H6BF2NO2 |
| Molecular Weight | 172.925 |
| Exact Mass | 173.046 |
| XLogP3 | -0.192 |
| Mr | 40.588 |
| PSA | 66.48 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 18 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | OB(c1cc(N)c(cc1F)F)O |
