3-(2-bromophenoxy)-4-oxo-4H-1-benzopyran-7-yl 4-fluorobenzoate
Chemical Structure Depiction of
3-(2-bromophenoxy)-4-oxo-4H-1-benzopyran-7-yl 4-fluorobenzoate
3-(2-bromophenoxy)-4-oxo-4H-1-benzopyran-7-yl 4-fluorobenzoate
Compound characteristics
| Compound ID: | 4300-0862 |
| Compound Name: | 3-(2-bromophenoxy)-4-oxo-4H-1-benzopyran-7-yl 4-fluorobenzoate |
| Molecular Weight: | 455.24 |
| Molecular Formula: | C22 H12 Br F O5 |
| Smiles: | C1=C(C(c2ccc(cc2O1)OC(c1ccc(cc1)F)=O)=O)Oc1ccccc1[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.9024 |
| logD: | 4.9024 |
| logSw: | -4.9967 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.034 |
| InChI Key: | XLUKNVOYNTZJNF-UHFFFAOYSA-N |