methyl 1'-ethyl-4'-nitro-1'H-[1,3'-bipyrazole]-3-carboxylate
Chemical Structure Depiction of
methyl 1'-ethyl-4'-nitro-1'H-[1,3'-bipyrazole]-3-carboxylate
methyl 1'-ethyl-4'-nitro-1'H-[1,3'-bipyrazole]-3-carboxylate
Compound characteristics
| Compound ID: | Y507-6108 |
| Compound Name: | methyl 1'-ethyl-4'-nitro-1'H-[1,3'-bipyrazole]-3-carboxylate |
| Molecular Weight: | 265.23 |
| Molecular Formula: | C10 H11 N5 O4 |
| Smiles: | CCn1cc(c(n1)n1ccc(C(=O)OC)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 0.591 |
| logD: | 0.591 |
| logSw: | -1.4335 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 82.945 |
| InChI Key: | JNDGXOCFINNDLT-UHFFFAOYSA-N |