3-(4-iodophenoxy)-4-oxo-4H-1-benzopyran-7-yl acetate
Chemical Structure Depiction of
3-(4-iodophenoxy)-4-oxo-4H-1-benzopyran-7-yl acetate
3-(4-iodophenoxy)-4-oxo-4H-1-benzopyran-7-yl acetate
Compound characteristics
| Compound ID: | Y041-3210 |
| Compound Name: | 3-(4-iodophenoxy)-4-oxo-4H-1-benzopyran-7-yl acetate |
| Molecular Weight: | 422.17 |
| Molecular Formula: | C17 H11 I O5 |
| Smiles: | CC(=O)Oc1ccc2C(C(=COc2c1)Oc1ccc(cc1)I)=O |
| Stereo: | ACHIRAL |
| logP: | 3.809 |
| logD: | 3.809 |
| logSw: | -4.0299 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.321 |
| InChI Key: | HLVYQLRNQGTGST-UHFFFAOYSA-N |