2-{(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)[4-(propan-2-yl)phenyl]methyl}-5,5-dimethylcyclohexane-1,3-dione
Chemical Structure Depiction of
2-{(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)[4-(propan-2-yl)phenyl]methyl}-5,5-dimethylcyclohexane-1,3-dione
2-{(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)[4-(propan-2-yl)phenyl]methyl}-5,5-dimethylcyclohexane-1,3-dione
Compound characteristics
| Compound ID: | 8008-1168 |
| Compound Name: | 2-{(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)[4-(propan-2-yl)phenyl]methyl}-5,5-dimethylcyclohexane-1,3-dione |
| Molecular Weight: | 410.55 |
| Molecular Formula: | C26 H34 O4 |
| Smiles: | CC(C)c1ccc(cc1)C(C1C(CC(C)(C)CC1=O)=O)C1=C(CC(C)(C)CC1=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2133 |
| logD: | 1.8802 |
| logSw: | -4.2831 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.001 |
| InChI Key: | ZOMSFOSRJXOPCQ-JOCHJYFZSA-N |