Base information
| Cat. No. | |
| CAS No. | 518336-26-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H12BNO2 |
| Molecular Weight | 164.997 |
| Exact Mass | 165.096 |
| XLogP3 | -0.5233 |
| Mr | 48.8423 |
| PSA | 52.49 |
| Sequence | - |
| Atom number | 24 |
| Bond number | 24 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | CNCc1ccc(cc1)B(O)O |
