methyl 3-chloro-2-hydroxy-4-(4-methylanilino)-4-oxo-2-(trifluoromethyl)butanoate
Chemical Structure Depiction of
methyl 3-chloro-2-hydroxy-4-(4-methylanilino)-4-oxo-2-(trifluoromethyl)butanoate
methyl 3-chloro-2-hydroxy-4-(4-methylanilino)-4-oxo-2-(trifluoromethyl)butanoate
Compound characteristics
| Compound ID: | Y508-9665 |
| Compound Name: | methyl 3-chloro-2-hydroxy-4-(4-methylanilino)-4-oxo-2-(trifluoromethyl)butanoate |
| Molecular Weight: | 339.7 |
| Molecular Formula: | C13 H13 Cl F3 N O4 |
| Smiles: | Cc1ccc(cc1)NC(C(C(C(=O)OC)(C(F)(F)F)O)[Cl])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.6103 |
| logD: | 2.61 |
| logSw: | -2.9348 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.843 |
| InChI Key: | DNNJZPZUNRYWFG-UHFFFAOYSA-N |