methyl 3-chloro-4-(3-chloroanilino)-2-hydroxy-4-oxo-2-(trifluoromethyl)butanoate
Chemical Structure Depiction of
methyl 3-chloro-4-(3-chloroanilino)-2-hydroxy-4-oxo-2-(trifluoromethyl)butanoate
methyl 3-chloro-4-(3-chloroanilino)-2-hydroxy-4-oxo-2-(trifluoromethyl)butanoate
Compound characteristics
| Compound ID: | Y508-9674 |
| Compound Name: | methyl 3-chloro-4-(3-chloroanilino)-2-hydroxy-4-oxo-2-(trifluoromethyl)butanoate |
| Molecular Weight: | 360.11 |
| Molecular Formula: | C12 H10 Cl2 F3 N O4 |
| Smiles: | COC(C(C(C(Nc1cccc(c1)[Cl])=O)[Cl])(C(F)(F)F)O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.9405 |
| logD: | 2.9213 |
| logSw: | -3.1876 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.843 |
| InChI Key: | MNGNIQUFGZUKQH-UHFFFAOYSA-N |