Base information
| Cat. No. | |
| CAS No. | 1357469-11-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H12O2 |
| Molecular Weight | 200.233 |
| Exact Mass | 200.084 |
| XLogP3 | 2.2347 |
| Mr | 57.9635 |
| PSA | 26.3 |
| Sequence | - |
| Atom number | 27 |
| Bond number | 28 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | COC(=O)c1ccccc1C#CC1CC1 |
