7-[2-(4-bromophenyl)-2-oxoethoxy]-3,4,8-trimethyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
7-[2-(4-bromophenyl)-2-oxoethoxy]-3,4,8-trimethyl-2H-1-benzopyran-2-one
7-[2-(4-bromophenyl)-2-oxoethoxy]-3,4,8-trimethyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-1889 |
| Compound Name: | 7-[2-(4-bromophenyl)-2-oxoethoxy]-3,4,8-trimethyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 401.26 |
| Molecular Formula: | C20 H17 Br O4 |
| Smiles: | CC1=C(C)c2ccc(c(C)c2OC1=O)OCC(c1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.8145 |
| logD: | 4.8145 |
| logSw: | -4.7714 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.405 |
| InChI Key: | NAVYOEWBWBTJHJ-UHFFFAOYSA-N |