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CS-W001157 4
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3-Methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline

  • CAS No. 1350377-66-0

  • Cat. No. CS-0059670
  • Purity≥98%
  • MDL No.None

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

3-Methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline|CS-0059670

Structure of 1350377-66-0

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General Information

  • CAS No. 1350377-66-0
  • Cat. No. CS-0059670
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₂₀BNO₃
  • Molecular Weight 249.11
  • Synonym(s) 3-methoxy-4-(tetramethyl-1,3,2-dioxaborolan-2-yl)aniline
  • SMILES B1(C=2C(=CC(=CC2)N)OC)OC(C)(C)C(O1)(C)C

Description

This boronate ester features a methoxy-substituted aniline scaffold, enabling direct coupling in Suzuki-Miyaura reactions. The tetramethyl-1,3,2-dioxaborolane moiety delivers exceptional stability and reactivity under standard conditions. Ideal for constructing biaryl architectures in medicinal chemistry and materials science workflows.

Application

3-Methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline serves as a versatile boronate building block for Suzuki-Miyaura cross-coupling reactions. The ortho-boronated aniline functionality enables efficient C–C bond formation under mild conditions, with the methoxy group providing electronic modulation and enhanced solubility. Bench-stable and readily purified by chromatography, it functions reliably in the synthesis of biaryl scaffolds and functionalized heterocycles common in pharmaceutical development.

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   53.71
  • LogP   1.5766
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   2

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