Base information
| Cat. No. | |
| CAS No. | 822-18-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C18H29NaO2 |
| Molecular Weight | 300.411 |
| Exact Mass | 300.207 |
| XLogP3 | 4.3258 |
| Mr | 87.0475 |
| PSA | 40.13 |
| Sequence | - |
| Atom number | 50 |
| Bond number | 48 |
| Ring number | 0 |
| Rotor number | 13 |
| Residues number | 0 |
| Canonical smiles | CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)[O-].[Na+] |
