methyl 4-hydroxy-3-methoxy-5-nitrobenzoate
Chemical Structure Depiction of
methyl 4-hydroxy-3-methoxy-5-nitrobenzoate
methyl 4-hydroxy-3-methoxy-5-nitrobenzoate
Compound characteristics
| Compound ID: | 8020-5079 |
| Compound Name: | methyl 4-hydroxy-3-methoxy-5-nitrobenzoate |
| Molecular Weight: | 227.17 |
| Molecular Formula: | C9 H9 N O6 |
| Smiles: | COC(c1cc(c(c(c1)OC)O)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4882 |
| logD: | -0.7361 |
| logSw: | -1.6496 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.602 |
| InChI Key: | ZQIHGTCQYHQBMY-UHFFFAOYSA-N |