Base information
| Cat. No. | |
| CAS No. | 25462-23-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H18O2 |
| Molecular Weight | 146.227 |
| Exact Mass | 146.131 |
| XLogP3 | 1.1675 |
| Mr | 42.8936 |
| PSA | 40.46 |
| Sequence | - |
| Atom number | 28 |
| Bond number | 27 |
| Ring number | 0 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | CCCCCC(CO)CO |
