7-[2-chloro-5-(trifluoromethyl)phenyl]-5-hydroxy-2H-1,3-benzoxathiol-2-one
Chemical Structure Depiction of
7-[2-chloro-5-(trifluoromethyl)phenyl]-5-hydroxy-2H-1,3-benzoxathiol-2-one
7-[2-chloro-5-(trifluoromethyl)phenyl]-5-hydroxy-2H-1,3-benzoxathiol-2-one
Compound characteristics
| Compound ID: | 5924-0113 |
| Compound Name: | 7-[2-chloro-5-(trifluoromethyl)phenyl]-5-hydroxy-2H-1,3-benzoxathiol-2-one |
| Molecular Weight: | 346.71 |
| Molecular Formula: | C14 H6 Cl F3 O3 S |
| Smiles: | c1cc(c(cc1C(F)(F)F)c1cc(cc2c1OC(=O)S2)O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.8625 |
| logD: | 4.8594 |
| logSw: | -4.7923 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.34 |
| InChI Key: | AAVFBARFNBCGIP-UHFFFAOYSA-N |