4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-2,6-dimethylphenyl acetate
Chemical Structure Depiction of
4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-2,6-dimethylphenyl acetate
4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-2,6-dimethylphenyl acetate
Compound characteristics
| Compound ID: | 8015-3517 |
| Compound Name: | 4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-2,6-dimethylphenyl acetate |
| Molecular Weight: | 330.22 |
| Molecular Formula: | C13 H12 F6 O3 |
| Smiles: | CC(=O)Oc1c(C)cc(cc1C)C(C(F)(F)F)(C(F)(F)F)O |
| Stereo: | ACHIRAL |
| logP: | 3.7051 |
| logD: | 3.6362 |
| logSw: | -3.9583 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.231 |
| InChI Key: | NGOJBGBJCWLLDI-UHFFFAOYSA-N |