dimethyl 2-(3,4-dimethoxyphenyl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 2-(3,4-dimethoxyphenyl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-dicarboxylate
dimethyl 2-(3,4-dimethoxyphenyl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-dicarboxylate
Compound characteristics
| Compound ID: | 5665-0021 |
| Compound Name: | dimethyl 2-(3,4-dimethoxyphenyl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-dicarboxylate |
| Molecular Weight: | 380.39 |
| Molecular Formula: | C19 H24 O8 |
| Smiles: | CC1(CC(C(C(C1C(=O)OC)c1ccc(c(c1)OC)OC)C(=O)OC)=O)O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.1757 |
| logD: | 1.1073 |
| logSw: | -1.8031 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.341 |
| InChI Key: | NXIUIOFJKMTCKN-UHFFFAOYSA-N |