2,4-bis{[4-(trifluoromethyl)phenyl]methylidene}thiolan-3-one
Chemical Structure Depiction of
2,4-bis{[4-(trifluoromethyl)phenyl]methylidene}thiolan-3-one
2,4-bis{[4-(trifluoromethyl)phenyl]methylidene}thiolan-3-one
Compound characteristics
| Compound ID: | C249-0036 |
| Compound Name: | 2,4-bis{[4-(trifluoromethyl)phenyl]methylidene}thiolan-3-one |
| Molecular Weight: | 414.37 |
| Molecular Formula: | C20 H12 F6 O S |
| Smiles: | C1C(=C/c2ccc(cc2)C(F)(F)F)\C(/C(=C/c2ccc(cc2)C(F)(F)F)S1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.4034 |
| logD: | 6.4034 |
| logSw: | -6.1803 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 13.3999 |
| InChI Key: | BYBSJTVCRMCENO-UHFFFAOYSA-N |