2-oxo-3-[4-(trifluoromethoxy)phenyl]-2H-1-benzopyran-7-yl acetate
Chemical Structure Depiction of
2-oxo-3-[4-(trifluoromethoxy)phenyl]-2H-1-benzopyran-7-yl acetate
2-oxo-3-[4-(trifluoromethoxy)phenyl]-2H-1-benzopyran-7-yl acetate
Compound characteristics
| Compound ID: | IB07-2740 |
| Compound Name: | 2-oxo-3-[4-(trifluoromethoxy)phenyl]-2H-1-benzopyran-7-yl acetate |
| Molecular Weight: | 364.28 |
| Molecular Formula: | C18 H11 F3 O5 |
| Smiles: | CC(=O)Oc1ccc2C=C(C(=O)Oc2c1)c1ccc(cc1)OC(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 4.02 |
| logD: | 4.02 |
| logSw: | -4.83 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 113.07 |
| InChI Key: | IHWVQEWVRGBIIP-UHFFFAOYSA-N |