tert-butyl {[2-oxo-4-(trifluoromethyl)-2H-1-benzopyran-7-yl]oxy}acetate
Chemical Structure Depiction of
tert-butyl {[2-oxo-4-(trifluoromethyl)-2H-1-benzopyran-7-yl]oxy}acetate
tert-butyl {[2-oxo-4-(trifluoromethyl)-2H-1-benzopyran-7-yl]oxy}acetate
Compound characteristics
| Compound ID: | D715-0005 |
| Compound Name: | tert-butyl {[2-oxo-4-(trifluoromethyl)-2H-1-benzopyran-7-yl]oxy}acetate |
| Molecular Weight: | 344.29 |
| Molecular Formula: | C16 H15 F3 O5 |
| Smiles: | CC(C)(C)OC(COc1ccc2C(=CC(=O)Oc2c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0538 |
| logD: | 3.0538 |
| logSw: | -3.3656 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.413 |
| InChI Key: | FEZQAKMEFIIEQN-UHFFFAOYSA-N |