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CAS 847818-78-4

:

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

Description:
1-(3,3-Diethoxypropyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole, with CAS number 847818-78-4, is a chemical compound characterized by its unique structural features that include a pyrazole ring and a boron-containing moiety. The presence of the diethoxypropyl group suggests that it may exhibit moderate hydrophobicity, while the dioxaborolane component can impart specific reactivity, particularly in coordination chemistry and organic synthesis. This compound may be of interest in medicinal chemistry and materials science due to its potential applications in drug development or as a building block in organic synthesis. Its stability, solubility, and reactivity can be influenced by the substituents on the pyrazole and boron moieties. Additionally, the presence of the tetramethyl group may enhance steric hindrance, affecting the compound's interactions with other molecules. Overall, this compound represents a complex structure that could be explored for various chemical applications, particularly in the fields of pharmaceuticals and agrochemicals.
Formula:C16H29BN2O4
InChI:InChI=1S/C16H29BN2O4/c1-7-20-14(21-8-2)10-12-19-13(9-11-18-19)17-22-15(3,4)16(5,6)23-17/h9,11,14H,7-8,10,12H2,1-6H3
InChI key:InChIKey=RQETUILOMRMBEL-UHFFFAOYSA-N
SMILES:C(CC(OCC)OCC)N1C(=CC=N1)B2OC(C)(C)C(C)(C)O2
Synonyms:
  • 1H-Pyrazole, 1-(3,3-diethoxypropyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
  • 1-(3,3-Diethoxypropyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
  • 1-(3,3-Diethoxypropyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole
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