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CAS 864754-17-6

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1-(1,3-Dioxolan-2-ylmethyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole

Description:
1-(1,3-Dioxolan-2-ylmethyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole is a complex organic compound characterized by its unique structural features, including a pyrazole ring and dioxaborolane moiety. The presence of the dioxolan group suggests potential solubility in polar solvents, while the dioxaborolane component may impart specific reactivity, particularly in boron chemistry. This compound is likely to exhibit interesting chemical properties, such as the ability to participate in various reactions, including nucleophilic substitutions and coordination with metal ions. Its molecular structure indicates potential applications in medicinal chemistry, particularly in the development of pharmaceuticals or agrochemicals, due to the bioactive nature of pyrazole derivatives. Additionally, the presence of boron may enhance its utility in materials science or catalysis. Overall, this compound represents a versatile scaffold for further chemical exploration and functionalization, making it of interest in both academic and industrial research settings.
Formula:C13H21BN2O4
InChI:InChI=1S/C13H21BN2O4/c1-12(2)13(3,4)20-14(19-12)10-7-15-16(8-10)9-11-17-5-6-18-11/h7-8,11H,5-6,9H2,1-4H3
InChI key:InChIKey=IWEGDQUCWQFKHS-UHFFFAOYSA-N
SMILES:CC1(C)OB(OC1(C)C)C2=CN(CC3OCCO3)N=C2
Synonyms:
  • 1-[(1,3-Dioxolan-2-yl)methyl]-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
  • 1-(1,3-Dioxolan-2-ylmethyl)-4-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
  • 1H-Pyrazole, 1-(1,3-dioxolan-2-ylmethyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
  • 1-(1,3-Dioxolan-2-ylmethyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
  • 1-[(1,3-Dioxolan-2-yl)methyl]-4-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
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