9-(5-bromo-2-methoxyphenyl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Chemical Structure Depiction of
9-(5-bromo-2-methoxyphenyl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
9-(5-bromo-2-methoxyphenyl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Compound characteristics
| Compound ID: | 8006-2660 |
| Compound Name: | 9-(5-bromo-2-methoxyphenyl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione |
| Molecular Weight: | 459.38 |
| Molecular Formula: | C24 H27 Br O4 |
| Smiles: | CC1(C)CC2=C(C(C3=C(CC(C)(C)CC3=O)O2)c2cc(ccc2OC)[Br])C(C1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1676 |
| logD: | 5.1676 |
| logSw: | -5.2096 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.028 |
| InChI Key: | VUXPXGLIMJWIGO-UHFFFAOYSA-N |