4-ethyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl benzenesulfonate
Chemical Structure Depiction of
4-ethyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl benzenesulfonate
4-ethyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl benzenesulfonate
Compound characteristics
| Compound ID: | Y041-5362 |
| Compound Name: | 4-ethyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl benzenesulfonate |
| Molecular Weight: | 344.38 |
| Molecular Formula: | C18 H16 O5 S |
| Smiles: | CCC1=CC(=O)Oc2c1ccc(c2C)OS(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6162 |
| logD: | 3.6162 |
| logSw: | -3.802 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 56.178 |
| InChI Key: | HFASBBKOMNREPM-UHFFFAOYSA-N |