methyl 3-fluoro-3-[(2-oxo-2-phenylethyl)sulfanyl]-2-(trifluoromethyl)prop-2-enoate
Chemical Structure Depiction of
methyl 3-fluoro-3-[(2-oxo-2-phenylethyl)sulfanyl]-2-(trifluoromethyl)prop-2-enoate
methyl 3-fluoro-3-[(2-oxo-2-phenylethyl)sulfanyl]-2-(trifluoromethyl)prop-2-enoate
Compound characteristics
| Compound ID: | 8012-6404 |
| Compound Name: | methyl 3-fluoro-3-[(2-oxo-2-phenylethyl)sulfanyl]-2-(trifluoromethyl)prop-2-enoate |
| Molecular Weight: | 322.28 |
| Molecular Formula: | C13 H10 F4 O3 S |
| Smiles: | COC(/C(=C(/F)SCC(c1ccccc1)=O)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2781 |
| logD: | 3.2781 |
| logSw: | -3.3907 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 34.659 |
| InChI Key: | JSPIOVVKZQUJIL-UHFFFAOYSA-N |