4-[4-(3,5-dinitrobenzamido)phenoxy]benzene-1,2-dicarboxylic acid
Chemical Structure Depiction of
4-[4-(3,5-dinitrobenzamido)phenoxy]benzene-1,2-dicarboxylic acid
4-[4-(3,5-dinitrobenzamido)phenoxy]benzene-1,2-dicarboxylic acid
Compound characteristics
| Compound ID: | 8005-5243 |
| Compound Name: | 4-[4-(3,5-dinitrobenzamido)phenoxy]benzene-1,2-dicarboxylic acid |
| Molecular Weight: | 467.35 |
| Molecular Formula: | C21 H13 N3 O10 |
| Smiles: | c1cc(ccc1NC(c1cc(cc(c1)[N+]([O-])=O)[N+]([O-])=O)=O)Oc1ccc(C(O)=O)c(c1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9003 |
| logD: | -0.308 |
| logSw: | -4.0498 |
| Hydrogen bond acceptors count: | 17 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 153.657 |
| InChI Key: | UNBNRZGQPGGNBV-UHFFFAOYSA-N |