dimethyl 1-phenyl-1H-pyrazole-3,4-dicarboxylate
Chemical Structure Depiction of
dimethyl 1-phenyl-1H-pyrazole-3,4-dicarboxylate
dimethyl 1-phenyl-1H-pyrazole-3,4-dicarboxylate
Compound characteristics
| Compound ID: | 8020-8710 |
| Compound Name: | dimethyl 1-phenyl-1H-pyrazole-3,4-dicarboxylate |
| Molecular Weight: | 260.25 |
| Molecular Formula: | C13 H12 N2 O4 |
| Smiles: | COC(c1cn(c2ccccc2)nc1C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 1.944 |
| logD: | 1.944 |
| logSw: | -2.4274 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.49 |
| InChI Key: | VABYYEHSSHPDRI-UHFFFAOYSA-N |