2,4,6-Trimethylpyrylium tetrafluoroborate

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2,4,6-Trimethylpyrylium tetrafluoroborate manufacturers

2,4,6-Trimethylpyrylium tetrafluoroborate Basic information
Product Name:2,4,6-Trimethylpyrylium tetrafluoroborate
Synonyms:TRIMETHYLPYRYLIUM TETRAFLUOROBORATE;AKOS 90396;2,4,6-Trimethylpyrylium tetrafluoroborate, 98+%;2,4,6-TRIMETHYLPYRILIUMTETRAFLUOROBORATE;2,4,6-Trimethylpyrylium tetrafluoroborate
CAS:773-01-3
MF:C8H11BF4O
MW:209.98
EINECS:212-256-2
Product Categories:Iodonium Sulfonium & Oxonium Compounds;Oxonium Compounds
Mol File:773-01-3.mol
2,4,6-Trimethylpyrylium tetrafluoroborate Structure
2,4,6-Trimethylpyrylium tetrafluoroborate Chemical Properties
Melting point 224-226°C
solubility Acetonitrile (Slightly), Methanol (Slightly, Heated)
form powder to crystaline
color White to Orange to Green
Water Solubility Soluble in water and methanol.
BRN 3639361
InChIInChI=1S/C8H11O.BF4/c1-6-4-7(2)9-8(3)5-6;2-1(3,4)5/h4-5H,1-3H3;/q+1;-1
InChIKeyPYOPRIFMELCENN-UHFFFAOYSA-N
SMILES[B-](F)(F)(F)F.C1(C)C=C([O+]=C(C)C=1)C
CAS DataBase Reference773-01-3(CAS DataBase Reference)
EPA Substance Registry SystemPyrylium, 2,4,6-trimethyl-, tetrafluoroborate(1-) (773-01-3)
Safety Information
Hazard Codes Xi
Risk Statements 36/37/38
Safety Statements 26-36/37/39
RIDADR UN 1759 8/PG III
TSCA TSCA listed
HS Code 2932.99.9090
HazardClass IRRITANT
PackingGroup III
MSDS Information
ProviderLanguage
ALFA English
2,4,6-Trimethylpyrylium tetrafluoroborate Usage And Synthesis
UsesIt is used in the radical Arylation Reactions of 4, 6, 8-Trimethylazulene.
SynthesisMethod 1: Acetic anhydride (100 mL, 1.06 mol, 13.0 eq.) and tert-butanol (8.00 mL, 84.2 mmol, 1.00 eq.) were added to a round-bottom flask equipped with a condenser and a dropping funnel. Fluoroboric acid (14 mL, 78 mmol, 0.95 eq.) was added dropwise. During its addition, the temperature was raised to 80°C. After completion of the exothermic reaction, the mixture was cooled to 5C and cold Et 2 O was added, the precipitate was collected, washed with cold Et 2 O and dried. 2,4,6-Trimethylpyranium tetrafluoroborate was obtained as a colorless solid (11.6 g, 55.4 mmol, 71%). 1H NMR (300 MHz, CD3OD, 300 K) δ= 7.87 (s, 2H, CHarom), 2.88 (s, 6H, 2× CH3), 2.72 (s, 3H, CH3). 13 C NMR (75MHz, CDCl 3, 300K) δ= 179.5 (Cq), 134.1 (Cq), 124.3 (CH), 21.1 (CH 3), 20.7 (CH 3). 19F NMR (282MHz, CD3OD, 300K) δ= -154.7. HRMS (ESI) m/z = 123.0804 Calculated values. MS (ESI): C8H11O [M] +, measured value: 123.0762. Spectral data is consistent with previously reported data.
2,4,6-Trimethylpyrylium tetrafluoroborate Preparation Products And Raw materials
Preparation Products4,6,8-Trimethylazulene
Tag:2,4,6-Trimethylpyrylium tetrafluoroborate(773-01-3) Related Product Information
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