Base information
| Cat. No. | |
| CAS No. | 1206640-91-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C18H24BNO3 |
| Molecular Weight | 313.199 |
| Exact Mass | 313.185 |
| XLogP3 | 2.55758 |
| Mr | 90.522 |
| PSA | 51.48 |
| Sequence | - |
| Atom number | 47 |
| Bond number | 49 |
| Ring number | 3 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | N#CC1(CCOCC1)c1ccc(cc1)B1OC(C(O1)(C)C)(C)C |
