4,4'-[(5-nitro-1,3-phenylene)bis(oxy)]dibenzoic acid
Chemical Structure Depiction of
4,4'-[(5-nitro-1,3-phenylene)bis(oxy)]dibenzoic acid
4,4'-[(5-nitro-1,3-phenylene)bis(oxy)]dibenzoic acid
Compound characteristics
| Compound ID: | K061-1012 |
| Compound Name: | 4,4'-[(5-nitro-1,3-phenylene)bis(oxy)]dibenzoic acid |
| Molecular Weight: | 395.32 |
| Molecular Formula: | C20 H13 N O8 |
| Smiles: | c1cc(ccc1C(O)=O)Oc1cc(cc(c1)Oc1ccc(cc1)C(O)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.2241 |
| logD: | 2.7065 |
| logSw: | -5.2157 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 103.932 |
| InChI Key: | IWBPPRDGNOTKQZ-UHFFFAOYSA-N |