3-iodo-4-nitro-1-(2,2,2-trifluoroethyl)-1H-pyrazole
Chemical Structure Depiction of
3-iodo-4-nitro-1-(2,2,2-trifluoroethyl)-1H-pyrazole
3-iodo-4-nitro-1-(2,2,2-trifluoroethyl)-1H-pyrazole
Compound characteristics
Compound ID: | Y507-5037 |
Compound Name: | 3-iodo-4-nitro-1-(2,2,2-trifluoroethyl)-1H-pyrazole |
Molecular Weight: | 320.99 |
Molecular Formula: | C5 H3 F3 I N3 O2 |
Smiles: | C(C(F)(F)F)n1cc(c(n1)I)[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 1.8803 |
logD: | 1.8803 |
logSw: | -2.0065 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 48.11 |
InChI Key: | VJZJSMZDZBEKAI-UHFFFAOYSA-N |