methyl 3-(4-methoxy-3-nitrophenyl)-1H-pyrazole-5-carboxylate
Chemical Structure Depiction of
methyl 3-(4-methoxy-3-nitrophenyl)-1H-pyrazole-5-carboxylate
methyl 3-(4-methoxy-3-nitrophenyl)-1H-pyrazole-5-carboxylate
Compound characteristics
| Compound ID: | 8020-2813 |
| Compound Name: | methyl 3-(4-methoxy-3-nitrophenyl)-1H-pyrazole-5-carboxylate |
| Molecular Weight: | 277.23 |
| Molecular Formula: | C12 H11 N3 O5 |
| Smiles: | COC(c1cc(c2ccc(c(c2)[N+]([O-])=O)OC)n[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0047 |
| logD: | 2.0045 |
| logSw: | -2.6104 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.613 |
| InChI Key: | GTSISNNFDJQXOF-UHFFFAOYSA-N |