2-(3-ethoxy-4-nitro-1H-pyrazol-1-yl)propanoic acid
Chemical Structure Depiction of
2-(3-ethoxy-4-nitro-1H-pyrazol-1-yl)propanoic acid
2-(3-ethoxy-4-nitro-1H-pyrazol-1-yl)propanoic acid
Compound characteristics
| Compound ID: | Y507-1149 |
| Compound Name: | 2-(3-ethoxy-4-nitro-1H-pyrazol-1-yl)propanoic acid |
| Molecular Weight: | 229.19 |
| Molecular Formula: | C8 H11 N3 O5 |
| Smiles: | CCOc1c(cn(C(C)C(O)=O)n1)[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.4142 |
| logD: | -3.0744 |
| logSw: | -0.7533 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.966 |
| InChI Key: | JKUJWIZRUWNYKG-YFKPBYRVSA-N |