6-(4-bromophenyl)-3-[2-(4-ethylphenyl)-2-oxoethyl]-3,5,5-trimethyloxane-2,4-dione
Chemical Structure Depiction of
6-(4-bromophenyl)-3-[2-(4-ethylphenyl)-2-oxoethyl]-3,5,5-trimethyloxane-2,4-dione
6-(4-bromophenyl)-3-[2-(4-ethylphenyl)-2-oxoethyl]-3,5,5-trimethyloxane-2,4-dione
Compound characteristics
| Compound ID: | 4605-0237 |
| Compound Name: | 6-(4-bromophenyl)-3-[2-(4-ethylphenyl)-2-oxoethyl]-3,5,5-trimethyloxane-2,4-dione |
| Molecular Weight: | 457.36 |
| Molecular Formula: | C24 H25 Br O4 |
| Smiles: | CCc1ccc(cc1)C(CC1(C)C(C(C)(C)C(c2ccc(cc2)[Br])OC1=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.0439 |
| logD: | 6.0439 |
| logSw: | -5.6499 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.8 |
| InChI Key: | BVIRUZCSUXQSMQ-UHFFFAOYSA-N |