4-[(1,3-dioxo-1,3-dihydro-2H-inden-2-ylidene)methyl]-2-ethoxy-6-iodophenyl benzoate
Chemical Structure Depiction of
4-[(1,3-dioxo-1,3-dihydro-2H-inden-2-ylidene)methyl]-2-ethoxy-6-iodophenyl benzoate
4-[(1,3-dioxo-1,3-dihydro-2H-inden-2-ylidene)methyl]-2-ethoxy-6-iodophenyl benzoate
Compound characteristics
| Compound ID: | Y500-9100 |
| Compound Name: | 4-[(1,3-dioxo-1,3-dihydro-2H-inden-2-ylidene)methyl]-2-ethoxy-6-iodophenyl benzoate |
| Molecular Weight: | 524.31 |
| Molecular Formula: | C25 H17 I O5 |
| Smiles: | CCOc1cc(C=C2C(c3ccccc3C2=O)=O)cc(c1OC(c1ccccc1)=O)I |
| Stereo: | ACHIRAL |
| logP: | 5.5733 |
| logD: | 5.5733 |
| logSw: | -5.6538 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 54.308 |
| InChI Key: | CYGRSBOCOGNFPB-UHFFFAOYSA-N |