di-tert-butyl 4-hydroxy-2-(3-hydroxyphenyl)-4-methyl-6-oxocyclohexane-1,3-dicarboxylate
Chemical Structure Depiction of
di-tert-butyl 4-hydroxy-2-(3-hydroxyphenyl)-4-methyl-6-oxocyclohexane-1,3-dicarboxylate
di-tert-butyl 4-hydroxy-2-(3-hydroxyphenyl)-4-methyl-6-oxocyclohexane-1,3-dicarboxylate
Compound characteristics
| Compound ID: | 5665-0101 |
| Compound Name: | di-tert-butyl 4-hydroxy-2-(3-hydroxyphenyl)-4-methyl-6-oxocyclohexane-1,3-dicarboxylate |
| Molecular Weight: | 420.5 |
| Molecular Formula: | C23 H32 O7 |
| Smiles: | CC1(CC(C(C(C1C(=O)OC(C)(C)C)c1cccc(c1)O)C(=O)OC(C)(C)C)=O)O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.8472 |
| logD: | 3.8387 |
| logSw: | -3.9909 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.076 |
| InChI Key: | AGQCMGOCQVNZSM-UHFFFAOYSA-N |