Base information
| Cat. No. | |
| CAS No. | 110-93-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H14O |
| Molecular Weight | 126.196 |
| Exact Mass | 126.104 |
| XLogP3 | 2.3218 |
| Mr | 40.296 |
| PSA | 17.07 |
| Sequence | - |
| Atom number | 23 |
| Bond number | 22 |
| Ring number | 0 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | CC(=O)CCC=C(C)C |
