5-methyl-2,4-dinitrobenzoic acid
Chemical Structure Depiction of
5-methyl-2,4-dinitrobenzoic acid
5-methyl-2,4-dinitrobenzoic acid
Compound characteristics
| Compound ID: | 8006-0654 |
| Compound Name: | 5-methyl-2,4-dinitrobenzoic acid |
| Molecular Weight: | 226.14 |
| Molecular Formula: | C8 H6 N2 O6 |
| Smiles: | Cc1cc(C(O)=O)c(cc1[N+]([O-])=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.9795 |
| logD: | -3.0793 |
| logSw: | -2.0272 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.808 |
| InChI Key: | SESSPRSOEAVOMC-UHFFFAOYSA-N |