methyl 1-(2-fluoro-4-nitrophenyl)-4-iodo-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
methyl 1-(2-fluoro-4-nitrophenyl)-4-iodo-1H-pyrazole-3-carboxylate
methyl 1-(2-fluoro-4-nitrophenyl)-4-iodo-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | Y507-3917 |
| Compound Name: | methyl 1-(2-fluoro-4-nitrophenyl)-4-iodo-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 391.09 |
| Molecular Formula: | C11 H7 F I N3 O4 |
| Smiles: | COC(c1c(cn(c2ccc(cc2F)[N+]([O-])=O)n1)I)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7248 |
| logD: | 2.7248 |
| logSw: | -3.1562 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.397 |
| InChI Key: | MBDWPRLZVKJSCO-UHFFFAOYSA-N |