Base information
| Cat. No. | |
| CAS No. | 501086-15-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H12O |
| Molecular Weight | 184.234 |
| Exact Mass | 184.089 |
| XLogP3 | 1.8124 |
| Mr | 57.7358 |
| PSA | 20.23 |
| Sequence | - |
| Atom number | 26 |
| Bond number | 26 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | C[C@H](CC#CC#Cc1ccccc1)O |
