9-(4-iodophenyl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Chemical Structure Depiction of
9-(4-iodophenyl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
9-(4-iodophenyl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Compound characteristics
| Compound ID: | 8003-7808 |
| Compound Name: | 9-(4-iodophenyl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione |
| Molecular Weight: | 476.35 |
| Molecular Formula: | C23 H25 I O3 |
| Smiles: | CC1(C)CC2=C(C(C3=C(CC(C)(C)CC3=O)O2)c2ccc(cc2)I)C(C1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2942 |
| logD: | 5.2942 |
| logSw: | -5.5189 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.397 |
| InChI Key: | MLOMNTUUWBNNIC-UHFFFAOYSA-N |