4-(2,4-dinitrobenzene-1-sulfonyl)benzoic acid
Chemical Structure Depiction of
4-(2,4-dinitrobenzene-1-sulfonyl)benzoic acid
4-(2,4-dinitrobenzene-1-sulfonyl)benzoic acid
Compound characteristics
| Compound ID: | 4433-0035 |
| Compound Name: | 4-(2,4-dinitrobenzene-1-sulfonyl)benzoic acid |
| Molecular Weight: | 352.28 |
| Molecular Formula: | C13 H8 N2 O8 S |
| Smiles: | c1cc(ccc1C(O)=O)S(c1ccc(cc1[N+]([O-])=O)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8127 |
| logD: | -0.2451 |
| logSw: | -3.4088 |
| Hydrogen bond acceptors count: | 15 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 124.609 |
| InChI Key: | PFFDCOWCLVDNOK-UHFFFAOYSA-N |