methyl [7-(acetyloxy)-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl]acetate
Chemical Structure Depiction of
methyl [7-(acetyloxy)-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl]acetate
methyl [7-(acetyloxy)-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl]acetate
Compound characteristics
| Compound ID: | Y043-7217 |
| Compound Name: | methyl [7-(acetyloxy)-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl]acetate |
| Molecular Weight: | 304.3 |
| Molecular Formula: | C16 H16 O6 |
| Smiles: | CC1=C(CC(=O)OC)C(=O)Oc2c1ccc(c2C)OC(C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1388 |
| logD: | 2.1388 |
| logSw: | -2.6965 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 62.261 |
| InChI Key: | GXAPEENAKSBQRZ-UHFFFAOYSA-N |