Base information
| Cat. No. | |
| CAS No. | 4798-46-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H14O |
| Molecular Weight | 114.185 |
| Exact Mass | 114.104 |
| XLogP3 | 1.5794 |
| Mr | 36.4508 |
| PSA | 20.23 |
| Sequence | - |
| Atom number | 22 |
| Bond number | 21 |
| Ring number | 0 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | C=CC(CC(C)C)O |
