ethyl 5-[2,6-dinitro-4-(trifluoromethyl)phenoxy]-2-phenyl-1-benzofuran-3-carboxylate
Chemical Structure Depiction of
ethyl 5-[2,6-dinitro-4-(trifluoromethyl)phenoxy]-2-phenyl-1-benzofuran-3-carboxylate
ethyl 5-[2,6-dinitro-4-(trifluoromethyl)phenoxy]-2-phenyl-1-benzofuran-3-carboxylate
Compound characteristics
| Compound ID: | Y041-2009 |
| Compound Name: | ethyl 5-[2,6-dinitro-4-(trifluoromethyl)phenoxy]-2-phenyl-1-benzofuran-3-carboxylate |
| Molecular Weight: | 516.39 |
| Molecular Formula: | C24 H15 F3 N2 O8 |
| Smiles: | CCOC(c1c2cc(ccc2oc1c1ccccc1)Oc1c(cc(cc1[N+]([O-])=O)C(F)(F)F)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2121 |
| logD: | 6.2121 |
| logSw: | -5.7109 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 102.329 |
| InChI Key: | DNLQHQPWCLPPGJ-UHFFFAOYSA-N |