4,6-dimethyl-2-oxo-2H-pyran-5-carboxylic acid
Chemical Structure Depiction of
4,6-dimethyl-2-oxo-2H-pyran-5-carboxylic acid
4,6-dimethyl-2-oxo-2H-pyran-5-carboxylic acid
Compound characteristics
| Compound ID: | K783-4538 |
| Compound Name: | 4,6-dimethyl-2-oxo-2H-pyran-5-carboxylic acid |
| Molecular Weight: | 168.15 |
| Molecular Formula: | C8 H8 O4 |
| Smiles: | CC1=CC(=O)OC(C)=C1C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.3738 |
| logD: | -5.9716 |
| logSw: | -0.2368 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.453 |
| InChI Key: | QOADIMYPCZMZSG-UHFFFAOYSA-N |