4-(butoxycarbonyl)phenyl 2-oxo-2H-1-benzopyran-3-carboxylate
Chemical Structure Depiction of
4-(butoxycarbonyl)phenyl 2-oxo-2H-1-benzopyran-3-carboxylate
4-(butoxycarbonyl)phenyl 2-oxo-2H-1-benzopyran-3-carboxylate
Compound characteristics
| Compound ID: | 2798-0152 |
| Compound Name: | 4-(butoxycarbonyl)phenyl 2-oxo-2H-1-benzopyran-3-carboxylate |
| Molecular Weight: | 366.37 |
| Molecular Formula: | C21 H18 O6 |
| Smiles: | CCCCOC(c1ccc(cc1)OC(C1=Cc2ccccc2OC1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7063 |
| logD: | 4.7063 |
| logSw: | -4.6207 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 62.586 |
| InChI Key: | YYOVBEFGZZLKFS-UHFFFAOYSA-N |