Base information
| Cat. No. | |
| CAS No. | 51593-96-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C14H20O3 |
| Molecular Weight | 236.307 |
| Exact Mass | 236.141 |
| XLogP3 | 1.9289 |
| Mr | 68.5916 |
| PSA | 49.69 |
| Sequence | - |
| Atom number | 37 |
| Bond number | 37 |
| Ring number | 1 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | OCCCc1ccc(cc1)OC/C=C(/CO)\C |
