methyl 3-chloro-4-(3-fluoro-4-methylanilino)-2-hydroxy-4-oxo-2-(trifluoromethyl)butanoate
Chemical Structure Depiction of
methyl 3-chloro-4-(3-fluoro-4-methylanilino)-2-hydroxy-4-oxo-2-(trifluoromethyl)butanoate
methyl 3-chloro-4-(3-fluoro-4-methylanilino)-2-hydroxy-4-oxo-2-(trifluoromethyl)butanoate
Compound characteristics
| Compound ID: | Y508-9677 |
| Compound Name: | methyl 3-chloro-4-(3-fluoro-4-methylanilino)-2-hydroxy-4-oxo-2-(trifluoromethyl)butanoate |
| Molecular Weight: | 357.69 |
| Molecular Formula: | C13 H12 Cl F4 N O4 |
| Smiles: | Cc1ccc(cc1F)NC(C(C(C(=O)OC)(C(F)(F)F)O)[Cl])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.8367 |
| logD: | 2.8116 |
| logSw: | -3.0141 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.843 |
| InChI Key: | DKMUMHMORVLGCA-UHFFFAOYSA-N |