ChemicalBook--->CAS DataBase List--->69807-91-6

69807-91-6

69807-91-6 Structure

69807-91-6 Structure
IdentificationBack Directory
[Name]

3,5-Bis(trifluoroMethyl)phenylboronic acid pinacol ester
[CAS]

69807-91-6
[Synonyms]

Pinacol 3,5-di(trifluoromethyl)benzeneboron
Pinacol 3,5-di(trifluoromethyl)benzeneboronate
3,5-Bis(trifluoroMethyl)phenylboronic acid pinacol ester
1,3,2-Dioxaborolane,2-[3,5-bis(trifluoromethyl)phenyl]-4,4,5...
2-(3,5-Bis(trifluoromethyl)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
1,3,2-Dioxaborolane, 2-[3,5-bis(trifluoromethyl)phenyl]-4,4,5,5-tetramethyl-
1,3-Bis(trifluoromethyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzene
[Molecular Formula]

C14H17BF6O3
[MDL Number]

MFCD12405516
[MOL File]

69807-91-6.mol
[Molecular Weight]

358
Chemical PropertiesBack Directory
[Melting point ]

65.0 to 69.0 °C
[storage temp. ]

Keep in dark place,Sealed in dry,Room Temperature
[solubility ]

soluble in Methanol
[form ]

powder to lump
[color ]

White to Almost white
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H319-H315
[Precautionary statements ]

P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
[HS Code ]

2934.99.4400
Spectrum DetailBack Directory
[Spectrum Detail]

3,5-Bis(trifluoroMethyl)phenylboronic acid pinacol ester(69807-91-6)1HNMR
Hazard InformationBack Directory
[Synthesis]

1,3-Bis(trifluoromethyl)-benzene

402-31-3

Pinacolborane

25015-63-8

3,5-Bis(trifluoroMethyl)phenylboronic acid pinacol ester

69807-91-6

General procedure: [RuCl2(p-cymene)]2 (2.3 mg, 3.8 μmol) and TpMe2K (2.5 mg, 7.5 μmol) were placed in a resealable Schlenk tube. The tube was evacuated, backfilled three times with nitrogen to remove air, and m-trifluorotoluene (5 mmol) was added. After stirring the mixture for 1 h at room temperature, pinacolborane (36 μL, 0.25 mmol) was slowly added via syringe. The reaction mixture was stirred at 120 °C for 16 hours. Upon completion of the reaction, the reaction mixture was analyzed by gas chromatography (GC) and gas chromatography-mass spectrometry (GC-MS). The volatile components were removed under reduced pressure and the residue was purified by short-range distillation (Kugelrohr distillation) to afford the target product 3,5-bis(trifluoromethyl)phenylboronic acid pinacol ester.

[References]

[1] Dalton Transactions, 2015, vol. 44, # 29, p. 13007 - 13016
[2] Organic and Biomolecular Chemistry, 2015, vol. 13, # 41, p. 10336 - 10340
[3] Organic letters, 2001, vol. 3, # 18, p. 2831 - 2833
[4] Journal of the American Chemical Society, 2000, vol. 122, # 51, p. 12868 - 12869
[5] Journal of the American Chemical Society, 2000, vol. 122, # 51, p. 12868 - 12869
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