5-methoxy-4-oxo-4H-pyran-2-carboxylic acid
Chemical Structure Depiction of
5-methoxy-4-oxo-4H-pyran-2-carboxylic acid
5-methoxy-4-oxo-4H-pyran-2-carboxylic acid
Compound characteristics
| Compound ID: | Y041-3948 |
| Compound Name: | 5-methoxy-4-oxo-4H-pyran-2-carboxylic acid |
| Molecular Weight: | 170.12 |
| Molecular Formula: | C7 H6 O5 |
| Smiles: | COC1=COC(=CC1=O)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.5219 |
| logD: | -4.5136 |
| logSw: | 0.1073 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.632 |
| InChI Key: | JQYYVBCIIMRLDL-UHFFFAOYSA-N |