Base information
| Cat. No. | |
| CAS No. | 5535-87-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C14H14O2 |
| Molecular Weight | 214.26 |
| Exact Mass | 214.099 |
| XLogP3 | 2.3802 |
| Mr | 62.768 |
| PSA | 18.46 |
| Sequence | - |
| Atom number | 30 |
| Bond number | 31 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | CC#CC#C/C=C\1/C=CC2(O1)CCCCO2 |
