1,3-dimethyl-4-nitro-1H-pyrazole-5-carboxylic acid
Chemical Structure Depiction of
1,3-dimethyl-4-nitro-1H-pyrazole-5-carboxylic acid
1,3-dimethyl-4-nitro-1H-pyrazole-5-carboxylic acid
Compound characteristics
| Compound ID: | 8014-2107 |
| Compound Name: | 1,3-dimethyl-4-nitro-1H-pyrazole-5-carboxylic acid |
| Molecular Weight: | 185.14 |
| Molecular Formula: | C6 H7 N3 O4 |
| Smiles: | Cc1c(c(C(O)=O)n(C)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | -0.5421 |
| logD: | -5.6795 |
| logSw: | -0.0642 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.295 |
| InChI Key: | MCTUAJONAXPWLC-UHFFFAOYSA-N |