4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-2,6-dimethylphenyl 2-fluorobenzoate
Chemical Structure Depiction of
4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-2,6-dimethylphenyl 2-fluorobenzoate
4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-2,6-dimethylphenyl 2-fluorobenzoate
Compound characteristics
| Compound ID: | 8015-3519 |
| Compound Name: | 4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-2,6-dimethylphenyl 2-fluorobenzoate |
| Molecular Weight: | 410.29 |
| Molecular Formula: | C18 H13 F7 O3 |
| Smiles: | Cc1cc(cc(C)c1OC(c1ccccc1F)=O)C(C(F)(F)F)(C(F)(F)F)O |
| Stereo: | ACHIRAL |
| logP: | 5.4511 |
| logD: | 5.3822 |
| logSw: | -5.355 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.858 |
| InChI Key: | XIVQKLUZEAYULG-UHFFFAOYSA-N |