bis(2-methoxyethyl) 2-(4-fluoro-3-phenoxyphenyl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-dicarboxylate
Chemical Structure Depiction of
bis(2-methoxyethyl) 2-(4-fluoro-3-phenoxyphenyl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-dicarboxylate
bis(2-methoxyethyl) 2-(4-fluoro-3-phenoxyphenyl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-dicarboxylate
Compound characteristics
| Compound ID: | 8017-7885 |
| Compound Name: | bis(2-methoxyethyl) 2-(4-fluoro-3-phenoxyphenyl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-dicarboxylate |
| Molecular Weight: | 518.54 |
| Molecular Formula: | C27 H31 F O9 |
| Smiles: | CC1(CC(C(C(C1C(=O)OCCOC)c1ccc(c(c1)Oc1ccccc1)F)C(=O)OCCOC)=O)O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.3496 |
| logD: | 2.3305 |
| logSw: | -2.7139 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.347 |
| InChI Key: | CFVOTOSUBYRPIK-UHFFFAOYSA-N |