8-methyl-4-propyl-7-{[3-(trifluoromethyl)phenyl]methoxy}-2H-1-benzopyran-2-one
Chemical Structure Depiction of
8-methyl-4-propyl-7-{[3-(trifluoromethyl)phenyl]methoxy}-2H-1-benzopyran-2-one
8-methyl-4-propyl-7-{[3-(trifluoromethyl)phenyl]methoxy}-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-7002 |
| Compound Name: | 8-methyl-4-propyl-7-{[3-(trifluoromethyl)phenyl]methoxy}-2H-1-benzopyran-2-one |
| Molecular Weight: | 376.37 |
| Molecular Formula: | C21 H19 F3 O3 |
| Smiles: | CCCC1=CC(=O)Oc2c1ccc(c2C)OCc1cccc(c1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 5.7776 |
| logD: | 5.7776 |
| logSw: | -5.6784 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 27.6442 |
| InChI Key: | KPUYGZZBKAXPIU-UHFFFAOYSA-N |