ethyl {[3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl]oxy}acetate
Chemical Structure Depiction of
ethyl {[3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl]oxy}acetate
ethyl {[3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl]oxy}acetate
Compound characteristics
| Compound ID: | 3992-2919 |
| Compound Name: | ethyl {[3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl]oxy}acetate |
| Molecular Weight: | 426.77 |
| Molecular Formula: | C20 H14 Cl F3 O5 |
| Smiles: | CCOC(COc1ccc2C(C(=C(C(F)(F)F)Oc2c1)c1ccc(cc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5361 |
| logD: | 4.5361 |
| logSw: | -4.7665 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.936 |
| InChI Key: | JDYQPRQMWZFACJ-UHFFFAOYSA-N |