3-hexyl-4,8-dimethyl-7-{[3-(trifluoromethyl)phenyl]methoxy}-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-hexyl-4,8-dimethyl-7-{[3-(trifluoromethyl)phenyl]methoxy}-2H-1-benzopyran-2-one
3-hexyl-4,8-dimethyl-7-{[3-(trifluoromethyl)phenyl]methoxy}-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y041-3030 |
| Compound Name: | 3-hexyl-4,8-dimethyl-7-{[3-(trifluoromethyl)phenyl]methoxy}-2H-1-benzopyran-2-one |
| Molecular Weight: | 432.48 |
| Molecular Formula: | C25 H27 F3 O3 |
| Smiles: | CCCCCCC1=C(C)c2ccc(c(C)c2OC1=O)OCc1cccc(c1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 7.9828 |
| logD: | 7.9828 |
| logSw: | -5.811 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 28.1586 |
| InChI Key: | OSOPALOQCRTTHH-UHFFFAOYSA-N |