Base information
| Cat. No. | |
| CAS No. | 66086-33-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H18O4 |
| Molecular Weight | 226.269 |
| Exact Mass | 226.121 |
| XLogP3 | 1.6732 |
| Mr | 60.606 |
| PSA | 52.6 |
| Sequence | - |
| Atom number | 34 |
| Bond number | 33 |
| Ring number | 0 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | O=C(OC(C)(C)C)C#CC(=O)OC(C)(C)C |
