methyl 4-(3-chloro-4-fluoroanilino)-2-hydroxy-4-oxo-2-(trifluoromethyl)butanoate
Chemical Structure Depiction of
methyl 4-(3-chloro-4-fluoroanilino)-2-hydroxy-4-oxo-2-(trifluoromethyl)butanoate
methyl 4-(3-chloro-4-fluoroanilino)-2-hydroxy-4-oxo-2-(trifluoromethyl)butanoate
Compound characteristics
| Compound ID: | Y508-9136 |
| Compound Name: | methyl 4-(3-chloro-4-fluoroanilino)-2-hydroxy-4-oxo-2-(trifluoromethyl)butanoate |
| Molecular Weight: | 343.66 |
| Molecular Formula: | C12 H10 Cl F4 N O4 |
| Smiles: | COC(C(CC(Nc1ccc(c(c1)[Cl])F)=O)(C(F)(F)F)O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3026 |
| logD: | 2.2748 |
| logSw: | -2.9983 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.097 |
| InChI Key: | WMAQAWCGWPDFTQ-LLVKDONJSA-N |