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Home > Encyclopedia > 5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)-2-pyrimidinamine

5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)-2-pyrimidinamine

5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)-2-pyrimidinamine structure

5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)-2-pyrimidinamine 

structure
  • CAS No:

    944401-58-5

  • Formula:

    C11H15BF3N3O2

  • Chemical Name:

    5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)-2-pyrimidinamine

  • Synonyms:

    2-Pyrimidinamine,5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)-;5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)-2-pyrimidinamine;[5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)pyrimidin-2-yl]amine;5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)pyrimidin-2-amine;2-Amino-4-trifluoromethylpyrimidine-5-boronic acid pinacol ester

  • Categories:

    Pharmaceutical Intermediates  >  Heterocyclic Compound

5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)-2-pyrimidinamine Basic Attributes

289.065

289.06

DTXSID10726108

2934999090

Characteristics

70.3

1.95800

1.3±0.1 g/cm3

198.0±31.5 °C

1.476

5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)-2-pyrimidinamine Use and Manufacturing

To a suspension of the product from step B.1 (16.2 g, 66.3 mmol), bis-pinacolatodiboron (18.5 g, 72.9 mmol) and KOAc (19.5 g, 199 mmol) in dioxane (300 mL) under argon was added PdClTo a suspension of 5-Bromo-4-trifluoromethyl-pyrimidin-2-ylamine (16.2 g, 66.3 mmol), bis-pinacolatodiboron (18.5 g, 72.9 mmol) and KOAc (19.5 g, 199 mmol) in dioxane (300 mL) under argon was added PdCl

Computed Properties

Molecular Weight:289.06
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:1
Exact Mass:289.1209414
Monoisotopic Mass:289.1209414
Topological Polar Surface Area:70.3
Heavy Atom Count:20
Complexity:362
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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