3,5-Dinitro-p-toluic acid
4-methyl-3,5-dinitrobenzoic acid
Also Known As: 4-Methyl-3,5-dinitrobenzoic acid|3,5-Dinitro-4-methylbenzoic acid|3,5-Dinitro-p-toluic acid|Benzoic acid, 4-methyl-3,5-dinitro-|ACMC-209dsg|p-Toluic acid, 3,5-dinitro-|3,5Dinitro4toluic acid|Benzoic acid,5-dinitro-|3,5-Dinitro-4-Methyl Benzoic Acid|p-Toluic acid,5-dinitro-|Oprea1_642861|2,4-DIAMINOAZOBENZENE|3,5Dinitro4methylbenzoic acid|3,5-DINITRO-4-TOLUIC ACID|EINECS 240-603-8|Jsp003318|-Methyl-3,5-dinitrobenzoic acid|3,5-Dinitro-4-methylbenzoicAcid|4-Methyl-3,5-dinitrobenzoicacid|AI3-14622|Benzoic acid, 4methyl3,5dinitro|4-methyl-3,5-dinitro-benzoic acid|KS-00000CD5
| Molecular Formula | C8H6N2O6 |
|---|---|
| Molecular Weight | 226.02258 g/mol |
| LogP | 1.51 |
| Topological Polar Surface Area | 123.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 226.02258 |
| Heavy Atoms | 16 |
| Complexity | 460.3 |
Chemical Identifiers
| CAS Number | 16533-71-4 |
|---|---|
| SMILES | CC1=C(C=C(C=C1[N+](=O)[O-])C(=O)O)[N+](=O)[O-] |
Product Overview
3,5-Dinitro-p-toluic acid (CAS 16533-71-4), with molecular formula C8H6N2O6 and molecular weight 226.02258 g/mol. IUPAC: 4-methyl-3,5-dinitrobenzoic acid.
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