7-[2-(4-bromophenyl)-2-oxoethoxy]-3-hexyl-4,8-dimethyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
7-[2-(4-bromophenyl)-2-oxoethoxy]-3-hexyl-4,8-dimethyl-2H-1-benzopyran-2-one
7-[2-(4-bromophenyl)-2-oxoethoxy]-3-hexyl-4,8-dimethyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y041-2012 |
| Compound Name: | 7-[2-(4-bromophenyl)-2-oxoethoxy]-3-hexyl-4,8-dimethyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 471.39 |
| Molecular Formula: | C25 H27 Br O4 |
| Smiles: | CCCCCCC1=C(C)c2ccc(c(C)c2OC1=O)OCC(c1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 7.4235 |
| logD: | 7.4235 |
| logSw: | -5.7282 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.405 |
| InChI Key: | YPVZXYSHZYAWAV-UHFFFAOYSA-N |