9-(4-ethoxy-3-iodo-5-methoxyphenyl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Chemical Structure Depiction of
9-(4-ethoxy-3-iodo-5-methoxyphenyl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
9-(4-ethoxy-3-iodo-5-methoxyphenyl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Compound characteristics
| Compound ID: | 8007-4500 |
| Compound Name: | 9-(4-ethoxy-3-iodo-5-methoxyphenyl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione |
| Molecular Weight: | 550.43 |
| Molecular Formula: | C26 H31 I O5 |
| Smiles: | CCOc1c(cc(cc1I)C1C2=C(CC(C)(C)CC2=O)OC2CC(C)(C)CC(C1=2)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 5.3479 |
| logD: | 5.3479 |
| logSw: | -5.358 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.325 |
| InChI Key: | CAOQKJZWMDCJGK-UHFFFAOYSA-N |