Base information
| Cat. No. | |
| CAS No. | 156938-09-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H12O4 |
| Molecular Weight | 184.189 |
| Exact Mass | 184.074 |
| XLogP3 | 0.8113 |
| Mr | 45.359 |
| PSA | 52.6 |
| Sequence | - |
| Atom number | 25 |
| Bond number | 25 |
| Ring number | 1 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | CC(=C)C(=O)OCC1CCC(=O)O1 |
