Base information
| Cat. No. | |
| CAS No. | 518-75-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H14O5 |
| Molecular Weight | 250.247 |
| Exact Mass | 250.084 |
| XLogP3 | 1.721 |
| Mr | 63.5836 |
| PSA | 83.83 |
| Sequence | - |
| Atom number | 32 |
| Bond number | 33 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | C[C@H]1OC=C2C(=C(C)C(=O)C(=C2O)C(=O)O)[C@@H]1C |
