2-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-5-methylphenyl acetate
Chemical Structure Depiction of
2-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-5-methylphenyl acetate
2-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-5-methylphenyl acetate
Compound characteristics
Compound ID: | 8013-1896 |
Compound Name: | 2-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-5-methylphenyl acetate |
Molecular Weight: | 316.2 |
Molecular Formula: | C12 H10 F6 O3 |
Smiles: | CC(=O)Oc1cc(C)ccc1C(C(F)(F)F)(C(F)(F)F)O |
Stereo: | ACHIRAL |
logP: | 3.3759 |
logD: | 3.307 |
logSw: | -3.4796 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 36.144 |
InChI Key: | TYRLBHKAPZWQRS-UHFFFAOYSA-N |