methyl 4-iodo-1-(2,2,2-trifluoroethyl)-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
methyl 4-iodo-1-(2,2,2-trifluoroethyl)-1H-pyrazole-3-carboxylate
methyl 4-iodo-1-(2,2,2-trifluoroethyl)-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | Y507-3845 |
| Compound Name: | methyl 4-iodo-1-(2,2,2-trifluoroethyl)-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 334.03 |
| Molecular Formula: | C7 H6 F3 I N2 O2 |
| Smiles: | COC(c1c(cn(CC(F)(F)F)n1)I)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9034 |
| logD: | 1.9034 |
| logSw: | -1.7821 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 36.736 |
| InChI Key: | IGNKRUBUEKHTLX-UHFFFAOYSA-N |