Base information
| Cat. No. | |
| CAS No. | 4063-75-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H10O4-- |
| Molecular Weight | 170.163 |
| Exact Mass | 170.058 |
| XLogP3 | -1.6854 |
| Mr | 39.495 |
| PSA | 80.26 |
| Sequence | - |
| Atom number | 22 |
| Bond number | 21 |
| Ring number | 0 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | C=CC(C(C(=O)[O-])(C(=O)[O-])C)C |
