Base information
| Cat. No. | |
| CAS No. | 2141947-89-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C20H20BNO4 |
| Molecular Weight | 349.188 |
| Exact Mass | 349.149 |
| XLogP3 | 3.46228 |
| Mr | 99.5365 |
| PSA | 68.55 |
| Sequence | - |
| Atom number | 46 |
| Bond number | 48 |
| Ring number | 3 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | O=Cc1cc(ccc1B1OC(C(O1)(C)C)(C)C)Oc1ccc(cc1)C#N |
