di(octan-2-yl) [1~1~,2~1~:2~4~,3~1~-terphenyl]-1~4~,3~4~-dicarboxylate
Chemical Structure Depiction of
di(octan-2-yl) [1~1~,2~1~:2~4~,3~1~-terphenyl]-1~4~,3~4~-dicarboxylate
di(octan-2-yl) [1~1~,2~1~:2~4~,3~1~-terphenyl]-1~4~,3~4~-dicarboxylate
Compound characteristics
| Compound ID: | 0077-0005 |
| Compound Name: | di(octan-2-yl) [1~1~,2~1~:2~4~,3~1~-terphenyl]-1~4~,3~4~-dicarboxylate |
| Molecular Weight: | 542.76 |
| Molecular Formula: | C36 H46 O4 |
| Smiles: | CCCCCCC(C)OC(c1ccc(cc1)c1ccc(cc1)c1ccc(cc1)C(=O)OC(C)CCCCCC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 12.1674 |
| logD: | 12.1674 |
| logSw: | -6.0288 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.327 |
| InChI Key: | OYCZMQPDDCPZMR-UHFFFAOYSA-N |