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CAS 58574-05-3

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1-tert-Butyl-3-nitro-4-chlorobenzene

Description:
1-tert-Butyl-3-nitro-4-chlorobenzene, with the CAS number 58574-05-3, is an organic compound characterized by its aromatic structure, which includes a tert-butyl group, a nitro group, and a chlorine atom attached to a benzene ring. This compound typically exhibits a pale yellow to brownish color and is known for its moderate solubility in organic solvents while being less soluble in water. The presence of the nitro and chloro substituents contributes to its reactivity, making it useful in various chemical syntheses and applications, including as an intermediate in the production of agrochemicals and pharmaceuticals. Its molecular structure influences its physical properties, such as melting and boiling points, which are generally higher than those of unsubstituted benzene derivatives due to increased molecular weight and intermolecular interactions. Safety data sheets indicate that it should be handled with care, as it may pose health risks upon exposure. Overall, 1-tert-Butyl-3-nitro-4-chlorobenzene is a significant compound in organic chemistry with diverse applications.
Formula:C10H12ClNO2
InChI:InChI=1/C10H12ClNO2/c1-10(2,3)7-4-5-8(11)9(6-7)12(13)14/h4-6H,1-3H3
SMILES:CC(C)(C)c1ccc(c(c1)N(=O)=O)Cl
Synonyms:
  • P-chloro-m-nitro-t-butylbenzene
  • 4-Tert-Butyl-1-Chloro-2-Nitrobenzene
  • 1-Tert-Butyl-3-Nitro-4-Chloro Benzene
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