ethyl 3-(7-butoxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)propanoate
Chemical Structure Depiction of
ethyl 3-(7-butoxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)propanoate
ethyl 3-(7-butoxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)propanoate
Compound characteristics
| Compound ID: | Y041-1782 |
| Compound Name: | ethyl 3-(7-butoxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)propanoate |
| Molecular Weight: | 332.4 |
| Molecular Formula: | C19 H24 O5 |
| Smiles: | CCCCOc1ccc2C(C)=C(CCC(=O)OCC)C(=O)Oc2c1 |
| Stereo: | ACHIRAL |
| logP: | 4.3992 |
| logD: | 4.3992 |
| logSw: | -4.3831 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.736 |
| InChI Key: | ROFQNMWXRUDQNS-UHFFFAOYSA-N |