Base information
| Cat. No. | |
| CAS No. | 4771-80-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H10O2 |
| Molecular Weight | 126.153 |
| Exact Mass | 126.068 |
| XLogP3 | 1.4273 |
| Mr | 34.9468 |
| PSA | 37.3 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 19 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | OC(=O)C1CCC=CC1 |
