Base information
| Cat. No. | |
| CAS No. | 497147-93-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H5BN2O2 |
| Molecular Weight | 147.927 |
| Exact Mass | 148.044 |
| XLogP3 | -1.36692 |
| Mr | 38.7776 |
| PSA | 77.14 |
| Sequence | - |
| Atom number | 16 |
| Bond number | 16 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | N#Cc1cncc(c1)B(O)O |
