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CAS 19756-72-0

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TERT-BUTYL 4-NITROBENZOATE

Description:
Tert-butyl 4-nitrobenzoate is an organic compound characterized by its ester functional group, derived from the reaction of tert-butyl alcohol and 4-nitrobenzoic acid. It typically appears as a pale yellow to light brown liquid or solid, depending on its purity and temperature. The compound is known for its relatively low solubility in water but is soluble in organic solvents such as ethanol and acetone. Tert-butyl 4-nitrobenzoate features a tert-butyl group, which contributes to its steric bulk, influencing its reactivity and interactions in chemical reactions. The presence of the nitro group on the aromatic ring enhances its electrophilic character, making it a useful intermediate in organic synthesis, particularly in the preparation of various pharmaceuticals and agrochemicals. Additionally, this compound is often utilized in studies involving reaction mechanisms and as a reagent in organic transformations. Safety precautions should be observed when handling this substance, as it may pose health risks if ingested or inhaled.
Formula:C11H13NO4
InChI:InChI=1/C11H13NO4/c1-11(2,3)16-10(13)8-4-6-9(7-5-8)12(14)15/h4-7H,1-3H3
SMILES:CC(C)(C)OC(=O)c1ccc(cc1)N(=O)=O
Synonyms:
  • Buttpark 18\02-56
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