{[4-(3-nitrophenyl)-2-oxo-2H-1-benzopyran-7-yl]oxy}acetic acid
Chemical Structure Depiction of
{[4-(3-nitrophenyl)-2-oxo-2H-1-benzopyran-7-yl]oxy}acetic acid
{[4-(3-nitrophenyl)-2-oxo-2H-1-benzopyran-7-yl]oxy}acetic acid
Compound characteristics
| Compound ID: | Y041-1966 |
| Compound Name: | {[4-(3-nitrophenyl)-2-oxo-2H-1-benzopyran-7-yl]oxy}acetic acid |
| Molecular Weight: | 341.27 |
| Molecular Formula: | C17 H11 N O7 |
| Smiles: | C(C(O)=O)Oc1ccc2C(=CC(=O)Oc2c1)c1cccc(c1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.3436 |
| logD: | -1.8934 |
| logSw: | -2.9919 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.639 |
| InChI Key: | GQOWSPHAQCQUFT-UHFFFAOYSA-N |