2-(3,4-diethoxyphenyl)-4,4,4-trifluoro-3-oxobutanenitrile
Chemical Structure Depiction of
2-(3,4-diethoxyphenyl)-4,4,4-trifluoro-3-oxobutanenitrile
2-(3,4-diethoxyphenyl)-4,4,4-trifluoro-3-oxobutanenitrile
Compound characteristics
| Compound ID: | 8020-0007 |
| Compound Name: | 2-(3,4-diethoxyphenyl)-4,4,4-trifluoro-3-oxobutanenitrile |
| Molecular Weight: | 301.26 |
| Molecular Formula: | C14 H14 F3 N O3 |
| Smiles: | CCOc1ccc(cc1OCC)C(C#N)C(C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3285 |
| logD: | 2.2214 |
| logSw: | -2.7705 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.454 |
| InChI Key: | GJXBOCUIFJXODA-SNVBAGLBSA-N |