methyl 6-nitro-2-oxo-2H-1-benzopyran-3-carboxylate
Chemical Structure Depiction of
methyl 6-nitro-2-oxo-2H-1-benzopyran-3-carboxylate
methyl 6-nitro-2-oxo-2H-1-benzopyran-3-carboxylate
Compound characteristics
| Compound ID: | 8003-7333 |
| Compound Name: | methyl 6-nitro-2-oxo-2H-1-benzopyran-3-carboxylate |
| Molecular Weight: | 249.18 |
| Molecular Formula: | C11 H7 N O6 |
| Smiles: | COC(C1=Cc2cc(ccc2OC1=O)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7101 |
| logD: | 1.7101 |
| logSw: | -2.176 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 75.715 |
| InChI Key: | CVKSEQDWXKMNGP-UHFFFAOYSA-N |