Base information
| Cat. No. | |
| CAS No. | 1256359-03-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C18H22BNO3 |
| Molecular Weight | 311.183 |
| Exact Mass | 311.169 |
| XLogP3 | 2.9598 |
| Mr | 91.692 |
| PSA | 40.58 |
| Sequence | - |
| Atom number | 45 |
| Bond number | 47 |
| Ring number | 3 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | CC1(C)OB(OC1(C)C)c1ccnc(c1)OCc1ccccc1 |
