Base information
| Cat. No. | |
| CAS No. | 625-44-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C5H12O |
| Molecular Weight | 88.1482 |
| Exact Mass | 88.0888 |
| XLogP3 | 1.2888 |
| Mr | 27.234 |
| PSA | 9.23 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 17 |
| Ring number | 0 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | COCC(C)C |
