4-chloro-3,5-dinitrobenzoic acid
Chemical Structure Depiction of
4-chloro-3,5-dinitrobenzoic acid
4-chloro-3,5-dinitrobenzoic acid
Compound characteristics
| Compound ID: | 0914-0013 |
| Compound Name: | 4-chloro-3,5-dinitrobenzoic acid |
| Molecular Weight: | 246.56 |
| Molecular Formula: | C7 H3 Cl N2 O6 |
| Smiles: | c1c(cc(c(c1[N+]([O-])=O)[Cl])[N+]([O-])=O)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8825 |
| logD: | -2.2172 |
| logSw: | -2.6037 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.808 |
| InChI Key: | PCTFIHOVQYYAMH-UHFFFAOYSA-N |