4,4'-[(5-methyl-1,3-phenylene)bis(oxy)]bis(5-nitrobenzene-1,2-dicarbonitrile)
Chemical Structure Depiction of
4,4'-[(5-methyl-1,3-phenylene)bis(oxy)]bis(5-nitrobenzene-1,2-dicarbonitrile)
4,4'-[(5-methyl-1,3-phenylene)bis(oxy)]bis(5-nitrobenzene-1,2-dicarbonitrile)
Compound characteristics
| Compound ID: | 8010-0128 |
| Compound Name: | 4,4'-[(5-methyl-1,3-phenylene)bis(oxy)]bis(5-nitrobenzene-1,2-dicarbonitrile) |
| Molecular Weight: | 466.37 |
| Molecular Formula: | C23 H10 N6 O6 |
| Smiles: | Cc1cc(cc(c1)Oc1cc(C#N)c(C#N)cc1[N+]([O-])=O)Oc1cc(C#N)c(C#N)cc1[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.1539 |
| logD: | 4.1539 |
| logSw: | -4.4754 |
| Hydrogen bond acceptors count: | 14 |
| Polar surface area: | 148.293 |
| InChI Key: | PRRBMWXJJGYONM-UHFFFAOYSA-N |