HuagongsheHuagongshe Chemistry Print Report · For research reference only
2-Hydroxy-6-oxo-2,4-heptadienoic acid
Identifiers & Physical Properties
| CAS No. | 7244-95-3 |
|---|---|
| Molecular formula | C7H8O4 |
| Average molar mass | 156.14 g/mol |
| Monoisotopic mass | 156.04225873 g/mol |
| SMILES | CC(=O)C=CC=C(O)C(=O)O |
| InChIKey | HVZGWILTESYJSP-UHFFFAOYSA-N |
| PubChem CID | 69 |
| ChEBI | CHEBI:90886 |
| DTXSID | DTXSID501285458 |
Chemical & Physical Properties
| XLogP | 0.2 |
|---|---|
| Topological polar surface area | 74.6 |
| Hydrogen bond donors | 2 |
| Hydrogen bond acceptors | 4 |
| Rotatable bonds | 3 |
| Heavy atoms | 11 |
| Formal charge | 0 |
| Complexity | 225 |