8-methyl-2-oxo-4-propyl-2H-1-benzopyran-7-yl methanesulfonate
Chemical Structure Depiction of
8-methyl-2-oxo-4-propyl-2H-1-benzopyran-7-yl methanesulfonate
8-methyl-2-oxo-4-propyl-2H-1-benzopyran-7-yl methanesulfonate
Compound characteristics
| Compound ID: | Y041-5336 |
| Compound Name: | 8-methyl-2-oxo-4-propyl-2H-1-benzopyran-7-yl methanesulfonate |
| Molecular Weight: | 296.34 |
| Molecular Formula: | C14 H16 O5 S |
| Smiles: | CCCC1=CC(=O)Oc2c1ccc(c2C)OS(C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6934 |
| logD: | 2.6934 |
| logSw: | -3.1179 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 56.565 |
| InChI Key: | SIWZGXPKBCWXJK-UHFFFAOYSA-N |