Base information
| Cat. No. | |
| CAS No. | 69956-77-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H18O3 |
| Molecular Weight | 258.312 |
| Exact Mass | 258.126 |
| XLogP3 | 3.4012 |
| Mr | 75.0058 |
| PSA | 54.37 |
| Sequence | - |
| Atom number | 37 |
| Bond number | 38 |
| Ring number | 2 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | OC(=O)C(c1ccc(cc1)/C=C/1\CCCCC1=O)C |
