CAS 1002309-48-9: 1-Cyclobutyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole

Description: 1-Cyclobutyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole is an organic compound characterized by its unique structural features, which include a cyclobutyl group and a pyrazole ring. The presence of the dioxaborolane moiety introduces boron into the structure, which can enhance its reactivity and potential applications in organic synthesis and medicinal chemistry. This compound is likely to exhibit properties typical of pyrazole derivatives, such as potential biological activity, including anti-inflammatory or anti-cancer effects, depending on the substituents and overall molecular architecture. The tetramethyl groups in the dioxaborolane contribute to steric hindrance, which may influence the compound's reactivity and solubility. Additionally, the presence of boron can facilitate coordination with other molecules, making it useful in various chemical reactions, including cross-coupling reactions. Overall, this compound represents a class of boron-containing heterocycles that are of interest in both synthetic and pharmaceutical chemistry.

Formula: C₁₃H₂₁BN₂O₂

InChI: InChI=1S/C13H21BN2O2/c1-12(2)13(3,4)18-14(17-12)10-8-15-16(9-10)11-6-5-7-11/h8-9,11H,5-7H2,1-4H3

InChI key: InChIKey=OBCTWWFLJFCNPC-UHFFFAOYSA-N

SMILES: N1=CC(=CN1C2CCC2)B3OC(C)(C)C(O3)(C)C

Synonyms:

• 1-Cyclobutyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole
• 1-Cyclobutyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
• 1H-Pyrazole, 1-cyclobutyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-

1H-Pyrazole, 1-cyclobutyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-

CAS: 1002309-48-9

• Formula: C₁₃H₂₁BN₂O₂
• Purity: 97%
• Color and Shape: Solid
• Molecular weight: 248.1290

1-Cyclobutyl-1H-pyrazole-4-boronic acid pinacol ester

CAS: 1002309-48-9

• Formula: C₁₃H₂₁BN₂O₂
• Purity: 97+%
• Color and Shape: off-white solid
• Molecular weight: 248.13g/mol

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

CAS: 1002309-48-9

• Purity: 95.0%
• Color and Shape: Solid
• Molecular weight: 248.1300048828125

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

CAS: 1002309-48-9

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• Formula: C₁₃H₂₁BN₂O₂
• Purity: Min. 95%
• Molecular weight: 248.13 g/mol