methyl 5-{[(4-ethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]methyl}furan-2-carboxylate
Chemical Structure Depiction of
methyl 5-{[(4-ethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]methyl}furan-2-carboxylate
methyl 5-{[(4-ethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]methyl}furan-2-carboxylate
Compound characteristics
| Compound ID: | Y041-9844 |
| Compound Name: | methyl 5-{[(4-ethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]methyl}furan-2-carboxylate |
| Molecular Weight: | 328.32 |
| Molecular Formula: | C18 H16 O6 |
| Smiles: | CCC1=CC(=O)Oc2cc(ccc12)OCc1ccc(C(=O)OC)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.1914 |
| logD: | 3.1914 |
| logSw: | -3.5073 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 56.889 |
| InChI Key: | JMBPYPNQMBYKRU-UHFFFAOYSA-N |