9-(2-bromo-5-ethoxy-4-hydroxyphenyl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Chemical Structure Depiction of
9-(2-bromo-5-ethoxy-4-hydroxyphenyl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
9-(2-bromo-5-ethoxy-4-hydroxyphenyl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Compound characteristics
| Compound ID: | 8009-4055 |
| Compound Name: | 9-(2-bromo-5-ethoxy-4-hydroxyphenyl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione |
| Molecular Weight: | 489.41 |
| Molecular Formula: | C25 H29 Br O5 |
| Smiles: | CCOc1cc(C2C3=C(CC(C)(C)CC3=O)OC3CC(C)(C)CC(C2=3)=O)c(cc1O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.6708 |
| logD: | 4.6694 |
| logSw: | -4.2484 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.156 |
| InChI Key: | MTIDBQMTJLLVER-UHFFFAOYSA-N |