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CAS 1125-30-0

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1,3,5-Trimethyl-4-nitro-1H-pyrazole

Description:
1,3,5-Trimethyl-4-nitro-1H-pyrazole is an organic compound characterized by its pyrazole ring structure, which is a five-membered ring containing two nitrogen atoms. The presence of three methyl groups at the 1, 3, and 5 positions contributes to its hydrophobic characteristics and influences its reactivity. The nitro group at the 4 position introduces significant polarity and can enhance the compound's reactivity, particularly in electrophilic substitution reactions. This compound is typically a solid at room temperature and may exhibit moderate solubility in organic solvents. Its chemical properties make it of interest in various fields, including pharmaceuticals and agrochemicals, where it may serve as an intermediate or a building block for more complex molecules. Additionally, the presence of both electron-donating (methyl) and electron-withdrawing (nitro) groups can affect its electronic properties, making it a subject of study in materials science and organic synthesis. Safety data should be consulted, as nitro compounds can be sensitive and potentially hazardous.
Formula:C6H9N3O2
InChI:InChI=1S/C6H9N3O2/c1-4-6(9(10)11)5(2)8(3)7-4/h1-3H3
InChI key:InChIKey=YSZYFGMARJFMJK-UHFFFAOYSA-N
SMILES:N(=O)(=O)C1=C(C)N(C)N=C1C
Synonyms:
  • 1,3,5-Trimethyl-4-nitropyrazole
  • 1,3,5-trimethyl-4-nitro-1H-pyrazole
  • 1H-Pyrazole, 1,3,5-trimethyl-4-nitro-
  • Pyrazole, 1,3,5-trimethyl-4-nitro-
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