7-[(2-methoxy-5-nitrophenyl)methoxy]-4-(trifluoromethyl)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
7-[(2-methoxy-5-nitrophenyl)methoxy]-4-(trifluoromethyl)-2H-1-benzopyran-2-one
7-[(2-methoxy-5-nitrophenyl)methoxy]-4-(trifluoromethyl)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-6608 |
| Compound Name: | 7-[(2-methoxy-5-nitrophenyl)methoxy]-4-(trifluoromethyl)-2H-1-benzopyran-2-one |
| Molecular Weight: | 395.29 |
| Molecular Formula: | C18 H12 F3 N O6 |
| Smiles: | COc1ccc(cc1COc1ccc2C(=CC(=O)Oc2c1)C(F)(F)F)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.5194 |
| logD: | 3.5194 |
| logSw: | -3.8937 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.885 |
| InChI Key: | ZDHVOKNEOWXURW-UHFFFAOYSA-N |