8-methyl-7-[2-(4-methylphenyl)-2-oxoethoxy]-4-(trifluoromethyl)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
8-methyl-7-[2-(4-methylphenyl)-2-oxoethoxy]-4-(trifluoromethyl)-2H-1-benzopyran-2-one
8-methyl-7-[2-(4-methylphenyl)-2-oxoethoxy]-4-(trifluoromethyl)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | D060-0001 |
| Compound Name: | 8-methyl-7-[2-(4-methylphenyl)-2-oxoethoxy]-4-(trifluoromethyl)-2H-1-benzopyran-2-one |
| Molecular Weight: | 376.33 |
| Molecular Formula: | C20 H15 F3 O4 |
| Smiles: | Cc1ccc(cc1)C(COc1ccc2C(=CC(=O)Oc2c1C)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2485 |
| logD: | 4.2485 |
| logSw: | -4.5089 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.891 |
| InChI Key: | HZIOKBCIWRBKAZ-UHFFFAOYSA-N |