7-[2-(4-bromophenyl)-2-oxoethoxy]-8-methyl-4-(trifluoromethyl)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
7-[2-(4-bromophenyl)-2-oxoethoxy]-8-methyl-4-(trifluoromethyl)-2H-1-benzopyran-2-one
7-[2-(4-bromophenyl)-2-oxoethoxy]-8-methyl-4-(trifluoromethyl)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-0059 |
| Compound Name: | 7-[2-(4-bromophenyl)-2-oxoethoxy]-8-methyl-4-(trifluoromethyl)-2H-1-benzopyran-2-one |
| Molecular Weight: | 441.2 |
| Molecular Formula: | C19 H12 Br F3 O4 |
| Smiles: | Cc1c(ccc2C(=CC(=O)Oc12)C(F)(F)F)OCC(c1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.659 |
| logD: | 4.659 |
| logSw: | -4.6094 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.891 |
| InChI Key: | YKCDVBMIPALPEN-UHFFFAOYSA-N |