di(propan-2-yl) 4-hydroxy-4-methyl-6-oxo-2-phenylcyclohexane-1,3-dicarboxylate
Chemical Structure Depiction of
di(propan-2-yl) 4-hydroxy-4-methyl-6-oxo-2-phenylcyclohexane-1,3-dicarboxylate
di(propan-2-yl) 4-hydroxy-4-methyl-6-oxo-2-phenylcyclohexane-1,3-dicarboxylate
Compound characteristics
Compound ID: | 3141-0307 |
Compound Name: | di(propan-2-yl) 4-hydroxy-4-methyl-6-oxo-2-phenylcyclohexane-1,3-dicarboxylate |
Molecular Weight: | 376.45 |
Molecular Formula: | C21 H28 O6 |
Smiles: | CC(C)OC(C1C(C(C(=O)OC(C)C)C(C)(CC1=O)O)c1ccccc1)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 3.1386 |
logD: | 3.1336 |
logSw: | -3.036 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 69.598 |
InChI Key: | FMJOKPRBXJEFND-UHFFFAOYSA-N |