5,5-dimethyl-2-{[3-(trifluoromethyl)anilino]methylidene}cyclohexane-1,3-dione
Chemical Structure Depiction of
5,5-dimethyl-2-{[3-(trifluoromethyl)anilino]methylidene}cyclohexane-1,3-dione
5,5-dimethyl-2-{[3-(trifluoromethyl)anilino]methylidene}cyclohexane-1,3-dione
Compound characteristics
| Compound ID: | 3856-0367 |
| Compound Name: | 5,5-dimethyl-2-{[3-(trifluoromethyl)anilino]methylidene}cyclohexane-1,3-dione |
| Molecular Weight: | 311.3 |
| Molecular Formula: | C16 H16 F3 N O2 |
| Smiles: | CC1(C)CC(C(=CNc2cccc(c2)C(F)(F)F)C(C1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5072 |
| logD: | 2.6812 |
| logSw: | -3.7756 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.256 |
| InChI Key: | KPASBSIREQPHBC-UHFFFAOYSA-N |