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CAS 29211-68-5

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3-tert-Butyl-2-pyrazolin-5-one

Description:
3-tert-Butyl-2-pyrazolin-5-one, with the CAS number 29211-68-5, is an organic compound belonging to the class of pyrazolines, which are five-membered heterocyclic compounds containing two nitrogen atoms. This substance is characterized by its pyrazoline ring structure, which includes a tert-butyl group at the 3-position and a carbonyl group at the 5-position. It typically appears as a crystalline solid and is known for its potential applications in various fields, including pharmaceuticals and agrochemicals. The compound exhibits notable properties such as antioxidant and anti-inflammatory activities, making it of interest in medicinal chemistry. Additionally, its stability and solubility in organic solvents can facilitate its use in synthetic processes. The presence of the tert-butyl group contributes to its steric bulk, which can influence its reactivity and interaction with biological targets. Overall, 3-tert-Butyl-2-pyrazolin-5-one is a versatile compound with significant implications in research and industry.
Formula:C7H12N2O
InChI:InChI=1/C7H12N2O/c1-7(2,3)5-4-6(10)9-8-5/h4H2,1-3H3,(H,9,10)
SMILES:CC(C)(C)C1=NN=C(C1)O
Synonyms:
  • 3-(tert-Butyl)-4,5-dihydro-1H-pyrazol-5-one
  • 5-tert-butyl-2,4-dihydro-3H-pyrazol-3-one
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