1,1'-(2,2,2-trichloroethane-1,1-diyl)bis(4-ethoxy-3,5-dinitrobenzene)
Chemical Structure Depiction of
1,1'-(2,2,2-trichloroethane-1,1-diyl)bis(4-ethoxy-3,5-dinitrobenzene)
1,1'-(2,2,2-trichloroethane-1,1-diyl)bis(4-ethoxy-3,5-dinitrobenzene)
Compound characteristics
Compound ID: | 0627-0356 |
Compound Name: | 1,1'-(2,2,2-trichloroethane-1,1-diyl)bis(4-ethoxy-3,5-dinitrobenzene) |
Molecular Weight: | 553.7 |
Molecular Formula: | C18 H15 Cl3 N4 O10 |
Smiles: | CCOc1c(cc(cc1[N+]([O-])=O)C(c1cc(c(c(c1)[N+]([O-])=O)OCC)[N+]([O-])=O)C([Cl])([Cl])[Cl])[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 5.507 |
logD: | 5.507 |
logSw: | -6.1625 |
Hydrogen bond acceptors count: | 18 |
Polar surface area: | 146.883 |
InChI Key: | PZGVFMGFBVSVFJ-UHFFFAOYSA-N |