2-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-4,5-dimethylphenyl acetate
Chemical Structure Depiction of
2-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-4,5-dimethylphenyl acetate
2-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-4,5-dimethylphenyl acetate
Compound characteristics
| Compound ID: | 8015-3523 |
| Compound Name: | 2-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-4,5-dimethylphenyl acetate |
| Molecular Weight: | 330.22 |
| Molecular Formula: | C13 H12 F6 O3 |
| Smiles: | CC(=O)Oc1cc(C)c(C)cc1C(C(F)(F)F)(C(F)(F)F)O |
| Stereo: | ACHIRAL |
| logP: | 3.886 |
| logD: | 3.8171 |
| logSw: | -3.9131 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.144 |
| InChI Key: | QGPYHSRQPTYQSO-UHFFFAOYSA-N |