HuagongsheHuagongshe Chemistry Print Report · For research reference only
Aldono-1,5-lactone
Identifiers & Physical Properties
| CAS No. | 52393-78-9 |
|---|---|
| Molecular formula | C6H10O6 |
| Average molar mass | 178.14 g/mol |
| Monoisotopic mass | 178.04773804 g/mol |
| SMILES | O=C1OC(CO)C(O)C(O)C1O |
| InChIKey | PHOQVHQSTUBQQK-UHFFFAOYSA-N |
| PubChem CID | 736 |
| ChEBI | CHEBI:74105 |
| DTXSID | DTXSID701354776 |
Chemical & Physical Properties
| XLogP | -2 |
|---|---|
| Topological polar surface area | 107 |
| Hydrogen bond donors | 4 |
| Hydrogen bond acceptors | 6 |
| Rotatable bonds | 1 |
| Heavy atoms | 12 |
| Formal charge | 0 |
| Complexity | 181 |