Base information
| Cat. No. | |
| CAS No. | 59995-47-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C5H6O2 |
| Molecular Weight | 98.0999 |
| Exact Mass | 98.0368 |
| XLogP3 | -0.1237 |
| Mr | 24.9228 |
| PSA | 37.3 |
| Sequence | - |
| Atom number | 13 |
| Bond number | 13 |
| Ring number | 1 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | O[C@H]1C=CC(=O)C1 |
