2,2'-[(4-methyl-2-oxo-3-propyl-2H-1-benzopyran-5,7-diyl)bis(oxy)]diacetic acid
Chemical Structure Depiction of
2,2'-[(4-methyl-2-oxo-3-propyl-2H-1-benzopyran-5,7-diyl)bis(oxy)]diacetic acid
2,2'-[(4-methyl-2-oxo-3-propyl-2H-1-benzopyran-5,7-diyl)bis(oxy)]diacetic acid
Compound characteristics
| Compound ID: | Y040-7120 |
| Compound Name: | 2,2'-[(4-methyl-2-oxo-3-propyl-2H-1-benzopyran-5,7-diyl)bis(oxy)]diacetic acid |
| Molecular Weight: | 350.32 |
| Molecular Formula: | C17 H18 O8 |
| Smiles: | CCCC1=C(C)c2c(cc(cc2OC1=O)OCC(O)=O)OCC(O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1673 |
| logD: | -2.0697 |
| logSw: | -2.0662 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.013 |
| InChI Key: | GUBFXVYRCMOFLY-UHFFFAOYSA-N |