Base information
| Cat. No. | |
| CAS No. | 13678-60-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C10H14O3 |
| Molecular Weight | 182.216 |
| Exact Mass | 182.094 |
| XLogP3 | 2.3689 |
| Mr | 48.994 |
| PSA | 39.44 |
| Sequence | - |
| Atom number | 27 |
| Bond number | 27 |
| Ring number | 1 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | CC(CC(=O)OCc1ccco1)C |
