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CAS 877401-11-1

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4-Bromo-β,β-dimethyl-1H-pyrazole-1-ethanol

Description:
4-Bromo-β,β-dimethyl-1H-pyrazole-1-ethanol is a chemical compound characterized by its pyrazole ring structure, which is a five-membered ring containing two adjacent nitrogen atoms. The presence of a bromine atom at the 4-position of the pyrazole ring contributes to its reactivity and potential applications in various chemical reactions. The β,β-dimethyl substituents indicate that there are two methyl groups attached to the carbon adjacent to the nitrogen in the pyrazole structure, enhancing its steric properties. The hydroxyl group (-OH) at the 1-position of the pyrazole ring classifies it as an alcohol, which can participate in hydrogen bonding, influencing its solubility and reactivity. This compound may exhibit biological activity, making it of interest in medicinal chemistry and agrochemical research. Its unique structural features allow for potential applications in the synthesis of other chemical entities or as a building block in organic synthesis. As with many brominated compounds, it is essential to handle it with care due to potential toxicity and environmental concerns.
Formula:C7H11BrN2O
InChI:InChI=1S/C7H11BrN2O/c1-7(2,5-11)10-4-6(8)3-9-10/h3-4,11H,5H2,1-2H3
InChI key:InChIKey=QNKVONNYXJUSKP-UHFFFAOYSA-N
SMILES:C(CO)(C)(C)N1C=C(Br)C=N1
Synonyms:
  • 1H-Pyrazole-1-ethanol, 4-bromo-β,β-dimethyl-
  • 4-Bromo-β,β-dimethyl-1H-pyrazole-1-ethanol
  • 2-(4-Bromopyrazol-1-yl)-2-methylpropan-1-ol
  • 2-(4-Bromo-1H-pyrazol-1-yl)-2-methylpropan-1-ol
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