3-nitro-2-[(4-nitrophenyl)carbamoyl]benzoic acid
Chemical Structure Depiction of
3-nitro-2-[(4-nitrophenyl)carbamoyl]benzoic acid
3-nitro-2-[(4-nitrophenyl)carbamoyl]benzoic acid
Compound characteristics
| Compound ID: | 8002-7175 |
| Compound Name: | 3-nitro-2-[(4-nitrophenyl)carbamoyl]benzoic acid |
| Molecular Weight: | 331.24 |
| Molecular Formula: | C14 H9 N3 O7 |
| Smiles: | c1cc(C(O)=O)c(C(Nc2ccc(cc2)[N+]([O-])=O)=O)c(c1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.4841 |
| logD: | -2.3843 |
| logSw: | -2.9037 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 118.2 |
| InChI Key: | WCFIMUCZBGRZPI-UHFFFAOYSA-N |