2-oxo-4-(trifluoromethyl)-2H-1-benzopyran-7-yl acetate
Chemical Structure Depiction of
2-oxo-4-(trifluoromethyl)-2H-1-benzopyran-7-yl acetate
2-oxo-4-(trifluoromethyl)-2H-1-benzopyran-7-yl acetate
Compound characteristics
| Compound ID: | D060-0096 |
| Compound Name: | 2-oxo-4-(trifluoromethyl)-2H-1-benzopyran-7-yl acetate |
| Molecular Weight: | 272.18 |
| Molecular Formula: | C12 H7 F3 O4 |
| Smiles: | CC(=O)Oc1ccc2C(=CC(=O)Oc2c1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 1.7825 |
| logD: | 1.7825 |
| logSw: | -2.479 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.397 |
| InChI Key: | JOHYKNHCOXRLMX-UHFFFAOYSA-N |