Base information
| Cat. No. | |
| CAS No. | 1604-28-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H12O |
| Molecular Weight | 124.18 |
| Exact Mass | 124.089 |
| XLogP3 | 2.0978 |
| Mr | 39.822 |
| PSA | 17.07 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 20 |
| Ring number | 0 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | CC(=CC=CC(=O)C)C |
