Base information
| Cat. No. | |
| CAS No. | 13058-38-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H10O |
| Molecular Weight | 110.154 |
| Exact Mass | 110.073 |
| XLogP3 | 1.7077 |
| Mr | 35.015 |
| PSA | 17.07 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 17 |
| Ring number | 0 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | C=CC(=O)C=C(C)C |
