4-octylphenyl 3'-fluoro-4'-[(octan-2-yl)oxy][1,1'-biphenyl]-4-carboxylate
Chemical Structure Depiction of
4-octylphenyl 3'-fluoro-4'-[(octan-2-yl)oxy][1,1'-biphenyl]-4-carboxylate
4-octylphenyl 3'-fluoro-4'-[(octan-2-yl)oxy][1,1'-biphenyl]-4-carboxylate
Compound characteristics
| Compound ID: | 1222-0174 |
| Compound Name: | 4-octylphenyl 3'-fluoro-4'-[(octan-2-yl)oxy][1,1'-biphenyl]-4-carboxylate |
| Molecular Weight: | 532.74 |
| Molecular Formula: | C35 H45 F O3 |
| Smiles: | CCCCCCCCc1ccc(cc1)OC(c1ccc(cc1)c1ccc(c(c1)F)OC(C)CCCCCC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 12.3797 |
| logD: | 12.3797 |
| logSw: | -5.7232 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 27.1171 |
| InChI Key: | WEJNHTMWRYDDIG-MHZLTWQESA-N |