Base information
| Cat. No. | |
| CAS No. | 1111637-69-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H6BFN2O2 |
| Molecular Weight | 179.944 |
| Exact Mass | 180.051 |
| XLogP3 | -0.6182 |
| Mr | 45.8773 |
| PSA | 69.14 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 20 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | OB(c1cnc2c(c1)c(F)c[nH]2)O |
