Base information
| Cat. No. | |
| CAS No. | 617-52-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H10O4 |
| Molecular Weight | 158.152 |
| Exact Mass | 158.058 |
| XLogP3 | 0.2787 |
| Mr | 37.859 |
| PSA | 52.6 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 20 |
| Ring number | 0 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | COC(=O)CC(=C)C(=O)OC |
