4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-2,6-dimethylphenyl thiophene-2-carboxylate
Chemical Structure Depiction of
4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-2,6-dimethylphenyl thiophene-2-carboxylate
4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-2,6-dimethylphenyl thiophene-2-carboxylate
Compound characteristics
| Compound ID: | 8015-3658 |
| Compound Name: | 4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-2,6-dimethylphenyl thiophene-2-carboxylate |
| Molecular Weight: | 398.32 |
| Molecular Formula: | C16 H12 F6 O3 S |
| Smiles: | Cc1cc(cc(C)c1OC(c1cccs1)=O)C(C(F)(F)F)(C(F)(F)F)O |
| Stereo: | ACHIRAL |
| logP: | 5.249 |
| logD: | 5.1801 |
| logSw: | -5.043 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.876 |
| InChI Key: | PDFKCGJLLIGXED-UHFFFAOYSA-N |