Base information
| Cat. No. | |
| CAS No. | 104-80-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H12O3 |
| Molecular Weight | 132.158 |
| Exact Mass | 132.079 |
| XLogP3 | -0.4814 |
| Mr | 32.2506 |
| PSA | 49.69 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 21 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | OCC1CCC(O1)CO |
