Base information
| Cat. No. | |
| CAS No. | 127277-53-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C10H13Ca2O5+ |
| Molecular Weight | 293.363 |
| Exact Mass | 293.001 |
| XLogP3 | 0.3978 |
| Mr | 52.1588 |
| PSA | 88.51 |
| Sequence | - |
| Atom number | 30 |
| Bond number | 28 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | CCC(=O)[C-]1C(=O)CC(CC1=O)C(=O)O.[Ca+2].[CaH2] |
