Base information
| Cat. No. | |
| CAS No. | 5217-05-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H12O2 |
| Molecular Weight | 128.169 |
| Exact Mass | 128.084 |
| XLogP3 | 1.6513 |
| Mr | 35.1608 |
| PSA | 37.3 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 21 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | OC(=O)C1(C)CCCC1 |
