9-(3-bromo-5-ethoxy-4-methoxyphenyl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Chemical Structure Depiction of
9-(3-bromo-5-ethoxy-4-methoxyphenyl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
9-(3-bromo-5-ethoxy-4-methoxyphenyl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Compound characteristics
| Compound ID: | 2144-0799 |
| Compound Name: | 9-(3-bromo-5-ethoxy-4-methoxyphenyl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione |
| Molecular Weight: | 503.43 |
| Molecular Formula: | C26 H31 Br O5 |
| Smiles: | CCOc1cc(cc(c1OC)[Br])C1C2=C(CC(C)(C)CC2=O)OC2CC(C)(C)CC(C1=2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9567 |
| logD: | 4.9567 |
| logSw: | -4.7145 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.325 |
| InChI Key: | UWGAMLLPESZOOV-UHFFFAOYSA-N |