7-[2-(4-bromophenyl)-2-oxoethoxy]-3-ethyl-4-methyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
7-[2-(4-bromophenyl)-2-oxoethoxy]-3-ethyl-4-methyl-2H-1-benzopyran-2-one
7-[2-(4-bromophenyl)-2-oxoethoxy]-3-ethyl-4-methyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-0641 |
| Compound Name: | 7-[2-(4-bromophenyl)-2-oxoethoxy]-3-ethyl-4-methyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 401.26 |
| Molecular Formula: | C20 H17 Br O4 |
| Smiles: | CCC1=C(C)c2ccc(cc2OC1=O)OCC(c1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.6421 |
| logD: | 4.6421 |
| logSw: | -4.5927 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.635 |
| InChI Key: | JRQYPYOTROKGBG-UHFFFAOYSA-N |