Base information
| Cat. No. | |
| CAS No. | 111943-62-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H16O2 |
| Molecular Weight | 204.265 |
| Exact Mass | 204.115 |
| XLogP3 | 3.4784 |
| Mr | 59.8015 |
| PSA | 26.3 |
| Sequence | - |
| Atom number | 31 |
| Bond number | 32 |
| Ring number | 2 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | CCCCCC1OC(=O)c2c1cccc2 |
