Base information
| Cat. No. | |
| CAS No. | 52496-08-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H12O4 |
| Molecular Weight | 148.157 |
| Exact Mass | 148.074 |
| XLogP3 | -0.3819 |
| Mr | 36.6914 |
| PSA | 77.76 |
| Sequence | - |
| Atom number | 22 |
| Bond number | 20 |
| Ring number | 0 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | OC(=O)C=C.OCCCO |
