Base information
| Cat. No. | |
| CAS No. | 111-28-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H10O |
| Molecular Weight | 98.143 |
| Exact Mass | 98.0732 |
| XLogP3 | 1.111 |
| Mr | 31.1698 |
| PSA | 20.23 |
| Sequence | - |
| Atom number | 17 |
| Bond number | 16 |
| Ring number | 0 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | CC=CC=CCO |
