di-tert-butyl 4-hydroxy-2-[4-(methoxycarbonyl)phenyl]-4-methyl-6-oxocyclohexane-1,3-dicarboxylate
Chemical Structure Depiction of
di-tert-butyl 4-hydroxy-2-[4-(methoxycarbonyl)phenyl]-4-methyl-6-oxocyclohexane-1,3-dicarboxylate
di-tert-butyl 4-hydroxy-2-[4-(methoxycarbonyl)phenyl]-4-methyl-6-oxocyclohexane-1,3-dicarboxylate
Compound characteristics
| Compound ID: | 5665-0096 |
| Compound Name: | di-tert-butyl 4-hydroxy-2-[4-(methoxycarbonyl)phenyl]-4-methyl-6-oxocyclohexane-1,3-dicarboxylate |
| Molecular Weight: | 462.54 |
| Molecular Formula: | C25 H34 O8 |
| Smiles: | CC1(CC(C(C(C1C(=O)OC(C)(C)C)c1ccc(cc1)C(=O)OC)C(=O)OC(C)(C)C)=O)O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.3763 |
| logD: | 4.3749 |
| logSw: | -4.5304 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.632 |
| InChI Key: | NWQZSXJTPDQDFV-UHFFFAOYSA-N |