Base information
| Cat. No. | |
| CAS No. | 72601-11-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H12O3 |
| Molecular Weight | 156.179 |
| Exact Mass | 156.079 |
| XLogP3 | 0.3238 |
| Mr | 41.2168 |
| PSA | 46.53 |
| Sequence | - |
| Atom number | 23 |
| Bond number | 22 |
| Ring number | 0 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | CCOC(=O)C#CC(O)(C)C |
