5-methyl-2-(propan-2-yl)cyclohexyl 4'-octyl[1,1'-biphenyl]-4-carboxylate
Chemical Structure Depiction of
5-methyl-2-(propan-2-yl)cyclohexyl 4'-octyl[1,1'-biphenyl]-4-carboxylate
5-methyl-2-(propan-2-yl)cyclohexyl 4'-octyl[1,1'-biphenyl]-4-carboxylate
Compound characteristics
| Compound ID: | 0435-5682 |
| Compound Name: | 5-methyl-2-(propan-2-yl)cyclohexyl 4'-octyl[1,1'-biphenyl]-4-carboxylate |
| Molecular Weight: | 448.69 |
| Molecular Formula: | C31 H44 O2 |
| Smiles: | CCCCCCCCc1ccc(cc1)c1ccc(cc1)C(=O)OC1CC(C)CCC1C(C)C |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 11.4971 |
| logD: | 11.4971 |
| logSw: | -5.9011 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 19.9937 |
| InChI Key: | DUORJTVBVQJQNS-UHFFFAOYSA-N |