Base information
| Cat. No. | |
| CAS No. | 1067250-06-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C31H40B2O8 |
| Molecular Weight | 562.266 |
| Exact Mass | 562.291 |
| XLogP3 | 4.2811 |
| Mr | 160.11 |
| PSA | 111.52 |
| Sequence | - |
| Atom number | 81 |
| Bond number | 85 |
| Ring number | 5 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | OC(=O)CCC1(CCC(=O)O)c2cc(ccc2-c2c1cc(cc2)B1OC(C(O1)(C)C)(C)C)B1OC(C(O1)(C)C)(C)C |
