1-methyl-4-nitro-1H-imidazole-5-carboxylic acid
Chemical Structure Depiction of
1-methyl-4-nitro-1H-imidazole-5-carboxylic acid
1-methyl-4-nitro-1H-imidazole-5-carboxylic acid
Compound characteristics
| Compound ID: | 8018-2952 |
| Compound Name: | 1-methyl-4-nitro-1H-imidazole-5-carboxylic acid |
| Molecular Weight: | 171.11 |
| Molecular Formula: | C5 H5 N3 O4 |
| Smiles: | Cn1cnc(c1C(O)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | -0.753 |
| logD: | -6.5842 |
| logSw: | -0.759 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.513 |
| InChI Key: | XYGGCGCFZDEPOI-UHFFFAOYSA-N |