Base information
| Cat. No. | |
| CAS No. | 5743-28-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H12CaO7 |
| Molecular Weight | 236.233 |
| Exact Mass | 236.021 |
| XLogP3 | -1.2467 |
| Mr | 40.392 |
| PSA | 116.45 |
| Sequence | - |
| Atom number | 26 |
| Bond number | 24 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | OC[C@@H]([C@H]1OC(=O)C(=C1O)O)O.O.[CaH2] |
