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CAS 51108-52-2

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4-Bromo-3,5-dimethyl-1-(1-methylethyl)-1H-pyrazole

Description:
4-Bromo-3,5-dimethyl-1-(1-methylethyl)-1H-pyrazole, with the CAS number 51108-52-2, is an organic compound characterized by its pyrazole ring structure, which is a five-membered ring containing two adjacent nitrogen atoms. This compound features a bromine substituent at the 4-position and two methyl groups at the 3 and 5 positions, along with an isopropyl group at the 1-position. The presence of these substituents contributes to its unique chemical properties, including its reactivity and potential applications in various fields such as pharmaceuticals and agrochemicals. The bromine atom enhances the compound's electrophilic character, making it useful in further chemical transformations. Additionally, the steric hindrance introduced by the isopropyl group may influence its interactions with biological targets. Overall, this compound's structure suggests potential utility in synthetic chemistry and medicinal applications, although specific biological activities would require further investigation.
Formula:C8H13BrN2
InChI:InChI=1S/C8H13BrN2/c1-5(2)11-7(4)8(9)6(3)10-11/h5H,1-4H3
InChI key:InChIKey=CXKZTTNVIBHWAQ-UHFFFAOYSA-N
SMILES:C(C)(C)N1C(C)=C(Br)C(C)=N1
Synonyms:
  • 4-Bromo-1-isopropyl-3,5-dimethylpyrazole
  • 4-Bromo-3,5-dimethyl-1-(1-methylethyl)-1H-pyrazole
  • 1H-Pyrazole, 4-bromo-3,5-dimethyl-1-(1-methylethyl)-
  • 1H-Pyrazole, 5-bromo-3,5-dimethyl-1-(1-methylethyl)-
  • 4-Bromo-1-isopropyl-3,5-dimethyl-1H-pyrazole
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