Base information
| Cat. No. | |
| CAS No. | 52386-21-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H17BO3 |
| Molecular Weight | 172.03 |
| Exact Mass | 172.127 |
| XLogP3 | 1.6118 |
| Mr | 48.56 |
| PSA | 27.69 |
| Sequence | - |
| Atom number | 29 |
| Bond number | 29 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | CCOB1OC(C)CC(O1)(C)C |
