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CAS 6279-89-6

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5-tert-butyl-1,3-dimethyl-2-nitrobenzene

Description:
5-tert-butyl-1,3-dimethyl-2-nitrobenzene, with the CAS number 6279-89-6, is an organic compound belonging to the class of nitro-substituted aromatic hydrocarbons. It features a benzene ring substituted with a nitro group and several alkyl groups, specifically tert-butyl and two methyl groups. This compound is characterized by its relatively high molecular weight and distinctive structural features that influence its chemical reactivity and physical properties. Typically, nitrobenzene derivatives exhibit moderate to low solubility in water but are more soluble in organic solvents. The presence of the nitro group imparts electrophilic characteristics, making it a potential candidate for various chemical reactions, including nucleophilic substitutions. Additionally, the bulky tert-butyl group can affect steric hindrance, influencing the compound's reactivity and interaction with other molecules. Safety considerations are important, as nitro compounds can be hazardous, and appropriate handling and storage protocols should be followed. Overall, 5-tert-butyl-1,3-dimethyl-2-nitrobenzene is of interest in both synthetic organic chemistry and materials science.
Formula:C12H17NO2
InChI:InChI=1/C12H17NO2/c1-8-6-10(12(3,4)5)7-9(2)11(8)13(14)15/h6-7H,1-5H3
SMILES:Cc1cc(cc(C)c1N(=O)=O)C(C)(C)C
Synonyms:
  • Benzene, 5-(1,1-Dimethylethyl)-1,3-Dimethyl-2-Nitro-
  • 5-tert-Butyl-1,3-dimethyl-2-nitrobenzene
  • 5-(tert-butyl)-1,3-dimethyl-2-nitrobenzene
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