methyl 4-(2-chloroanilino)-2-hydroxy-4-oxo-2-(trifluoromethyl)butanoate
Chemical Structure Depiction of
methyl 4-(2-chloroanilino)-2-hydroxy-4-oxo-2-(trifluoromethyl)butanoate
methyl 4-(2-chloroanilino)-2-hydroxy-4-oxo-2-(trifluoromethyl)butanoate
Compound characteristics
| Compound ID: | Y509-0779 |
| Compound Name: | methyl 4-(2-chloroanilino)-2-hydroxy-4-oxo-2-(trifluoromethyl)butanoate |
| Molecular Weight: | 325.67 |
| Molecular Formula: | C12 H11 Cl F3 N O4 |
| Smiles: | COC(C(CC(Nc1ccccc1[Cl])=O)(C(F)(F)F)O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6232 |
| logD: | 1.6228 |
| logSw: | -2.1054 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.399 |
| InChI Key: | ADYZKYHQWXASTQ-LLVKDONJSA-N |