diethyl 4-hydroxy-4-methyl-6-oxo-2-(4-propoxyphenyl)cyclohexane-1,3-dicarboxylate
Chemical Structure Depiction of
diethyl 4-hydroxy-4-methyl-6-oxo-2-(4-propoxyphenyl)cyclohexane-1,3-dicarboxylate
diethyl 4-hydroxy-4-methyl-6-oxo-2-(4-propoxyphenyl)cyclohexane-1,3-dicarboxylate
Compound characteristics
| Compound ID: | K908-0014 |
| Compound Name: | diethyl 4-hydroxy-4-methyl-6-oxo-2-(4-propoxyphenyl)cyclohexane-1,3-dicarboxylate |
| Molecular Weight: | 406.48 |
| Molecular Formula: | C22 H30 O7 |
| Smiles: | CCCOc1ccc(cc1)C1C(C(CC(C)(C1C(=O)OCC)O)=O)C(=O)OCC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.2847 |
| logD: | 3.2656 |
| logSw: | -3.0144 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.657 |
| InChI Key: | SNBBMVIZPATJKD-UHFFFAOYSA-N |