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CS-W001157 4
Total: USD 88.00

4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzo[d]oxazole

  • CAS No. 2055713-74-9

  • Cat. No. CS-0613237
  • Purity≥98%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzo[d]oxazole|CS-0613237

Structure of 2055713-74-9

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General Information

  • CAS No. 2055713-74-9
  • Cat. No. CS-0613237
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₆BNO₃
  • Molecular Weight 245.08
  • Synonym(s) None
  • SMILES CC1(C)C(C)(C)OB(C2=C3N=COC3=CC=C2)O1

Description

4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzo[d]oxazole features a boronate ester group enabling reliable Suzuki-Miyaura cross-coupling reactions. The benzo[d]oxazole core provides rigidity and electron-rich character, enhancing stability under standard reaction conditions. This compound serves as a key building block for synthesizing biaryl scaffolds in pharmaceutical and materials chemistry.

Application

4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzo[d]oxazole serves as a robust boronate building block for Suzuki-Miyaura cross-coupling reactions. Its stability under ambient conditions and tolerance to diverse functional groups enable reliable C–C bond formation in complex molecule synthesis. The benzo[d]oxazole core provides a rigid, electron-deficient scaffold useful in pharmaceutical and materials chemistry.

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   44.49
  • LogP   2.127
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   1

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