2-ethoxy-4-(3,3,6,6-tetramethyl-1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)phenyl 4-fluorobenzoate
Chemical Structure Depiction of
2-ethoxy-4-(3,3,6,6-tetramethyl-1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)phenyl 4-fluorobenzoate
2-ethoxy-4-(3,3,6,6-tetramethyl-1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)phenyl 4-fluorobenzoate
Compound characteristics
| Compound ID: | 5547-0182 |
| Compound Name: | 2-ethoxy-4-(3,3,6,6-tetramethyl-1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)phenyl 4-fluorobenzoate |
| Molecular Weight: | 532.61 |
| Molecular Formula: | C32 H33 F O6 |
| Smiles: | CCOc1cc(ccc1OC(c1ccc(cc1)F)=O)C1C2=C(CC(C)(C)CC2=O)OC2CC(C)(C)CC(C1=2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3755 |
| logD: | 5.3755 |
| logSw: | -5.5564 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 61.072 |
| InChI Key: | JVQWTXXZDKRAIN-UHFFFAOYSA-N |