ethyl 5-methyl-1-(4-nitrophenyl)-1H-1,2,3-triazole-4-carboxylate
Chemical Structure Depiction of
ethyl 5-methyl-1-(4-nitrophenyl)-1H-1,2,3-triazole-4-carboxylate
ethyl 5-methyl-1-(4-nitrophenyl)-1H-1,2,3-triazole-4-carboxylate
Compound characteristics
| Compound ID: | 8011-2788 |
| Compound Name: | ethyl 5-methyl-1-(4-nitrophenyl)-1H-1,2,3-triazole-4-carboxylate |
| Molecular Weight: | 276.25 |
| Molecular Formula: | C12 H12 N4 O4 |
| Smiles: | CCOC(c1c(C)n(c2ccc(cc2)[N+]([O-])=O)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8481 |
| logD: | 1.8481 |
| logSw: | -2.0687 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 81.217 |
| InChI Key: | MWCUXTSZLSCUIV-UHFFFAOYSA-N |