Base information
| Cat. No. | |
| CAS No. | 53988-05-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C18H34CaO4 |
| Molecular Weight | 354.538 |
| Exact Mass | 354.208 |
| XLogP3 | 2.6856 |
| Mr | 90.413 |
| PSA | 80.26 |
| Sequence | - |
| Atom number | 57 |
| Bond number | 54 |
| Ring number | 0 |
| Rotor number | 12 |
| Residues number | 0 |
| Canonical smiles | CC(CCCCCC(=O)[O-])C.CC(CCCCCC(=O)[O-])C.[Ca+2] |
