methyl 4-[3,3,3-trifluoro-2-(trifluoromethyl)propanamido]benzoate
Chemical Structure Depiction of
methyl 4-[3,3,3-trifluoro-2-(trifluoromethyl)propanamido]benzoate
methyl 4-[3,3,3-trifluoro-2-(trifluoromethyl)propanamido]benzoate
Compound characteristics
| Compound ID: | 8019-0896 |
| Compound Name: | methyl 4-[3,3,3-trifluoro-2-(trifluoromethyl)propanamido]benzoate |
| Molecular Weight: | 329.2 |
| Molecular Formula: | C12 H9 F6 N O3 |
| Smiles: | COC(c1ccc(cc1)NC(C(C(F)(F)F)C(F)(F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4742 |
| logD: | 3.4741 |
| logSw: | -3.596 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.775 |
| InChI Key: | QPEMIYPKGHGGHE-UHFFFAOYSA-N |