6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl methanesulfonate
Chemical Structure Depiction of
6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl methanesulfonate
6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl methanesulfonate
Compound characteristics
| Compound ID: | Y041-5353 |
| Compound Name: | 6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl methanesulfonate |
| Molecular Weight: | 350.78 |
| Molecular Formula: | C16 H11 Cl O5 S |
| Smiles: | CS(=O)(=O)Oc1cc2c(cc1[Cl])C(=CC(=O)O2)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.1639 |
| logD: | 3.1639 |
| logSw: | -3.8039 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 56.61 |
| InChI Key: | RPHXWOWBFULFCP-UHFFFAOYSA-N |