dimethyl 2,2'-[(4-oxo-2-phenyl-4H-1-benzopyran-5,7-diyl)bis(oxy)]diacetate
Chemical Structure Depiction of
dimethyl 2,2'-[(4-oxo-2-phenyl-4H-1-benzopyran-5,7-diyl)bis(oxy)]diacetate
dimethyl 2,2'-[(4-oxo-2-phenyl-4H-1-benzopyran-5,7-diyl)bis(oxy)]diacetate
Compound characteristics
| Compound ID: | Y042-0110 |
| Compound Name: | dimethyl 2,2'-[(4-oxo-2-phenyl-4H-1-benzopyran-5,7-diyl)bis(oxy)]diacetate |
| Molecular Weight: | 398.37 |
| Molecular Formula: | C21 H18 O8 |
| Smiles: | COC(COc1cc(c2C(C=C(c3ccccc3)Oc2c1)=O)OCC(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5308 |
| logD: | 2.5308 |
| logSw: | -2.7668 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 78.028 |
| InChI Key: | DKAWPFHBHCHXDQ-UHFFFAOYSA-N |