1-ethyl-3-nitro-1H-pyrazole-4-carboxylic acid
Chemical Structure Depiction of
1-ethyl-3-nitro-1H-pyrazole-4-carboxylic acid
1-ethyl-3-nitro-1H-pyrazole-4-carboxylic acid
Compound characteristics
| Compound ID: | Y507-1041 |
| Compound Name: | 1-ethyl-3-nitro-1H-pyrazole-4-carboxylic acid |
| Molecular Weight: | 185.14 |
| Molecular Formula: | C6 H7 N3 O4 |
| Smiles: | CCn1cc(C(O)=O)c(n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 0.3775 |
| logD: | -4.4666 |
| logSw: | -1.2478 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.239 |
| InChI Key: | VDFPLBHYELEAKI-UHFFFAOYSA-N |