Base information
| Cat. No. | |
| CAS No. | 68957-00-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C5H8O2 |
| Molecular Weight | 100.116 |
| Exact Mass | 100.052 |
| XLogP3 | 0.2939 |
| Mr | 26.6278 |
| PSA | 29.46 |
| Sequence | - |
| Atom number | 15 |
| Bond number | 14 |
| Ring number | 0 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | OCCOC=C=C |
