ethyl 5-hydroxy-6,10-dimethoxy-2-(1,1,2,2-tetrafluoroethyl)-4,5-dihydro-2H-2,5-methanofuro[3,2-h][1,3]benzoxathiepine-4-carboxylate
Chemical Structure Depiction of
ethyl 5-hydroxy-6,10-dimethoxy-2-(1,1,2,2-tetrafluoroethyl)-4,5-dihydro-2H-2,5-methanofuro[3,2-h][1,3]benzoxathiepine-4-carboxylate
ethyl 5-hydroxy-6,10-dimethoxy-2-(1,1,2,2-tetrafluoroethyl)-4,5-dihydro-2H-2,5-methanofuro[3,2-h][1,3]benzoxathiepine-4-carboxylate
Compound characteristics
| Compound ID: | 4351-0059 |
| Compound Name: | ethyl 5-hydroxy-6,10-dimethoxy-2-(1,1,2,2-tetrafluoroethyl)-4,5-dihydro-2H-2,5-methanofuro[3,2-h][1,3]benzoxathiepine-4-carboxylate |
| Molecular Weight: | 466.4 |
| Molecular Formula: | C19 H18 F4 O7 S |
| Smiles: | CCOC(C1C2(CC(C(C(F)F)(F)F)(Oc3c2c(c2ccoc2c3OC)OC)S1)O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.7483 |
| logD: | 3.7483 |
| logSw: | -4.353 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.242 |
| InChI Key: | HSTSJRSSHFKGQN-UHFFFAOYSA-N |