4,6-dimethyl-3-[4,4,4-trifluoro-3-(hydroxyimino)butanoyl]pyridin-2(1H)-one
Chemical Structure Depiction of
4,6-dimethyl-3-[4,4,4-trifluoro-3-(hydroxyimino)butanoyl]pyridin-2(1H)-one
4,6-dimethyl-3-[4,4,4-trifluoro-3-(hydroxyimino)butanoyl]pyridin-2(1H)-one
Compound characteristics
| Compound ID: | D140-0064 |
| Compound Name: | 4,6-dimethyl-3-[4,4,4-trifluoro-3-(hydroxyimino)butanoyl]pyridin-2(1H)-one |
| Molecular Weight: | 276.21 |
| Molecular Formula: | C11 H11 F3 N2 O3 |
| Smiles: | CC1=CC(C)=C(C(C/C(C(F)(F)F)=N/O)=O)C(N1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8435 |
| logD: | -0.1617 |
| logSw: | -1.6526 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.723 |
| InChI Key: | XAYQIAJKLUSVJB-UHFFFAOYSA-N |