3-(2,5-dimethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl 4-fluorobenzoate
Chemical Structure Depiction of
3-(2,5-dimethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl 4-fluorobenzoate
3-(2,5-dimethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl 4-fluorobenzoate
Compound characteristics
| Compound ID: | 4358-3637 |
| Compound Name: | 3-(2,5-dimethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl 4-fluorobenzoate |
| Molecular Weight: | 404.39 |
| Molecular Formula: | C24 H17 F O5 |
| Smiles: | Cc1ccc(C)c(c1)OC1=COc2cc(ccc2C1=O)OC(c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2424 |
| logD: | 5.2424 |
| logSw: | -5.1401 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.034 |
| InChI Key: | AERMFPLGAFWIFD-UHFFFAOYSA-N |