Base information
| Cat. No. | |
| CAS No. | 111-59-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H40O2 |
| Molecular Weight | 324.541 |
| Exact Mass | 324.303 |
| XLogP3 | 6.9771 |
| Mr | 103.872 |
| PSA | 26.3 |
| Sequence | - |
| Atom number | 63 |
| Bond number | 62 |
| Ring number | 0 |
| Rotor number | 18 |
| Residues number | 0 |
| Canonical smiles | CCCCCCCC/C=C\CCCCCCCC(=O)OCCC |
