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CAS 96-90-2

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1-Chloro-2-methyl-3,5-dinitrobenzene

Description:
1-Chloro-2-methyl-3,5-dinitrobenzene, with the CAS number 96-90-2, is an organic compound that belongs to the class of nitro-substituted aromatic compounds. It features a benzene ring substituted with a chlorine atom, a methyl group, and two nitro groups at the 3 and 5 positions. This compound is typically a yellow crystalline solid, exhibiting a relatively high melting point and low solubility in water, but it is soluble in organic solvents. The presence of the nitro groups contributes to its electron-withdrawing properties, making it a potential candidate for various chemical reactions, including nucleophilic substitutions. Due to its chlorine and nitro substituents, it may also exhibit significant reactivity and potential toxicity, necessitating careful handling and storage. Additionally, 1-chloro-2-methyl-3,5-dinitrobenzene can be used in the synthesis of other chemical compounds and may have applications in research and industry, particularly in the field of explosives and dyes.
Formula:C7H5ClN2O4
InChI:InChI=1S/C7H5ClN2O4/c1-4-6(8)2-5(9(11)12)3-7(4)10(13)14/h2-3H,1H3
InChI key:InChIKey=UECPDWARCDGMQV-UHFFFAOYSA-N
SMILES:N(=O)(=O)C1=CC(N(=O)=O)=CC(Cl)=C1C
Synonyms:
  • 1-Chloro-2-methyl-3,5-dinitrobenzene
  • 2-Chloro-4,6-dinitrotoluene
  • 6-Chloro-2,4-dinitrotoluene
  • Toluene, 2-chloro-4,6-dinitro-
  • Toluene,2-chloro-4,6-dinitro- (8CI)
  • Benzene, 1-chloro-2-methyl-3,5-dinitro-
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