6-(4-bromophenyl)-3-[2-(4-tert-butylphenyl)-2-oxoethyl]-3,5,5-trimethyloxane-2,4-dione
Chemical Structure Depiction of
6-(4-bromophenyl)-3-[2-(4-tert-butylphenyl)-2-oxoethyl]-3,5,5-trimethyloxane-2,4-dione
6-(4-bromophenyl)-3-[2-(4-tert-butylphenyl)-2-oxoethyl]-3,5,5-trimethyloxane-2,4-dione
Compound characteristics
| Compound ID: | 4605-0236 |
| Compound Name: | 6-(4-bromophenyl)-3-[2-(4-tert-butylphenyl)-2-oxoethyl]-3,5,5-trimethyloxane-2,4-dione |
| Molecular Weight: | 485.42 |
| Molecular Formula: | C26 H29 Br O4 |
| Smiles: | CC(C)(C)c1ccc(cc1)C(CC1(C)C(C(C)(C)C(c2ccc(cc2)[Br])OC1=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.9077 |
| logD: | 6.9077 |
| logSw: | -5.8372 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.8 |
| InChI Key: | ZKFAEYWYOWSQBV-UHFFFAOYSA-N |