methyl (4,7-dimethyl-2-oxo-5-propoxy-2H-1-benzopyran-3-yl)acetate
Chemical Structure Depiction of
methyl (4,7-dimethyl-2-oxo-5-propoxy-2H-1-benzopyran-3-yl)acetate
methyl (4,7-dimethyl-2-oxo-5-propoxy-2H-1-benzopyran-3-yl)acetate
Compound characteristics
| Compound ID: | Y040-3507 |
| Compound Name: | methyl (4,7-dimethyl-2-oxo-5-propoxy-2H-1-benzopyran-3-yl)acetate |
| Molecular Weight: | 304.34 |
| Molecular Formula: | C17 H20 O5 |
| Smiles: | CCCOc1cc(C)cc2c1C(C)=C(CC(=O)OC)C(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 3.7378 |
| logD: | 3.7378 |
| logSw: | -4.1553 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.243 |
| InChI Key: | YCPJHXQIZIAQOK-UHFFFAOYSA-N |