Base information
| Cat. No. | |
| CAS No. | 158442-03-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H42O2 |
| Molecular Weight | 326.557 |
| Exact Mass | 326.318 |
| XLogP3 | 6.7688 |
| Mr | 104.346 |
| PSA | 26.3 |
| Sequence | - |
| Atom number | 65 |
| Bond number | 64 |
| Ring number | 0 |
| Rotor number | 16 |
| Residues number | 0 |
| Canonical smiles | CC(CCCC(C)C)CCCCCCCCCOC(=O)C(C)C |
