ethyl 5-phenyl-2-(1,1,1-trifluoro-3-methoxy-3-oxopropan-2-ylidene)-2H-1,3-oxathiole-4-carboxylate
Chemical Structure Depiction of
ethyl 5-phenyl-2-(1,1,1-trifluoro-3-methoxy-3-oxopropan-2-ylidene)-2H-1,3-oxathiole-4-carboxylate
ethyl 5-phenyl-2-(1,1,1-trifluoro-3-methoxy-3-oxopropan-2-ylidene)-2H-1,3-oxathiole-4-carboxylate
Compound characteristics
| Compound ID: | 4157-4510 |
| Compound Name: | ethyl 5-phenyl-2-(1,1,1-trifluoro-3-methoxy-3-oxopropan-2-ylidene)-2H-1,3-oxathiole-4-carboxylate |
| Molecular Weight: | 374.33 |
| Molecular Formula: | C16 H13 F3 O5 S |
| Smiles: | CCOC(C1=C(c2ccccc2)O/C(=C(/C(=O)OC)C(F)(F)F)S1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0272 |
| logD: | 4.0272 |
| logSw: | -4.1285 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 52.124 |
| InChI Key: | SOIAWOQSOUAHMP-UHFFFAOYSA-N |