Base information
| Cat. No. | |
| CAS No. | 126-86-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C14H26O2 |
| Molecular Weight | 226.355 |
| Exact Mass | 226.193 |
| XLogP3 | 2.584 |
| Mr | 69.9736 |
| PSA | 40.46 |
| Sequence | - |
| Atom number | 42 |
| Bond number | 41 |
| Ring number | 0 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | CC(CC(C#CC(CC(C)C)(O)C)(O)C)C |
