Base information
| Cat. No. | |
| CAS No. | 106842-97-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H16O4 |
| Molecular Weight | 236.264 |
| Exact Mass | 236.105 |
| XLogP3 | 2.1981 |
| Mr | 63.3068 |
| PSA | 63.6 |
| Sequence | - |
| Atom number | 33 |
| Bond number | 33 |
| Ring number | 1 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | CCOC(=O)CC(c1ccccc1)CC(=O)O |
