Base information
| Cat. No. | |
| CAS No. | 79-29-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H14 |
| Molecular Weight | 86.1754 |
| Exact Mass | 86.1096 |
| XLogP3 | 2.2984 |
| Mr | 30.956 |
| PSA | 0 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 19 |
| Ring number | 0 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | CC(C(C)C)C |
