Base information
| Cat. No. | |
| CAS No. | 684282-41-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H14O3 |
| Molecular Weight | 218.248 |
| Exact Mass | 218.094 |
| XLogP3 | 2.535 |
| Mr | 58.713 |
| PSA | 39.44 |
| Sequence | - |
| Atom number | 30 |
| Bond number | 32 |
| Ring number | 3 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | O=C(C1CC2CC1C=C2)OCc1ccco1 |
