Base information
| Cat. No. | |
| CAS No. | 42789-13-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H20O2 |
| Molecular Weight | 160.254 |
| Exact Mass | 160.146 |
| XLogP3 | 1.7001 |
| Mr | 47.7006 |
| PSA | 40.46 |
| Sequence | - |
| Atom number | 31 |
| Bond number | 30 |
| Ring number | 0 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | CCCCCCCC(CO)O |
