Base information
| Cat. No. | |
| CAS No. | 13002-09-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H26O2 |
| Molecular Weight | 202.334 |
| Exact Mass | 202.193 |
| XLogP3 | 3.4578 |
| Mr | 61.968 |
| PSA | 18.46 |
| Sequence | - |
| Atom number | 40 |
| Bond number | 39 |
| Ring number | 0 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | CC(OCCC(C)C)OCCC(C)C |
