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Chemical Structure| 2622-67-5

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Product Details of [ 2622-67-5 ]

CAS No. :2622-67-5
Formula : C19H14N2
M.W : 270.33
SMILES Code : C1=CC=C(C=C1)N1C2=CC=CC=C2N=C1C1=CC=CC=C1
MDL No. :MFCD00416995
InChI Key :ZLGVZKQXZYQJSM-UHFFFAOYSA-N
Pubchem ID :137661

Safety of [ 2622-67-5 ]

GHS Pictogram:
Signal Word:Warning
Hazard Statements:H302-H312-H332
Precautionary Statements:P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P330-P363-P501

Application In Synthesis of [ 2622-67-5 ]

* All experimental methods are cited from the reference, please refer to the original source for details. We do not guarantee the accuracy of the content in the reference.

  • Downstream synthetic route of [ 2622-67-5 ]

[ 2622-67-5 ] Synthesis Path-Downstream   1~1

  • 1
  • [iridium(III)(μ-chloro)(2-phenylpyridine)2]2 [ No CAS ]
  • [ 2622-67-5 ]
  • [ 94928-86-6 ]
  • C41H29IrN4 [ No CAS ]
YieldReaction ConditionsOperation in experiment
0.29 g With sodium carbonate; In glycerol; at 240℃; for 12h;Inert atmosphere; Bis[1,2-diphenyl-1H-benzo[d]-imidazole](2-phenylpyridine)iridium(III) [Ir(ppy)2pbi]: Hppy (0.31 g, 2.0 mmol) was dissolved into a mixed solution of 2-ethoxyethanol (12 mL) and water (4 mL) in a 25 mL round bottomed flask, and then IrCl3·3H2O (0.28 g, 0.8 mmol) was added. The mixture was stirred under nitrogen at 120 °C for 12 h. The mixture was cooled to room temperature and the precipitate was collected and washed with water, ethanol, and acetone, then dried in vacuum to give a cyclometalated Ir-mu-chloro-bridged dimer. The dimer complex, Hpbi (0.27 g, 1.0 mmol), Na2CO3 (0.34 g, 3.2 mmol) and 5mL glycerol were charged into a round bottomed flask, the mixture was then heated to 240 °C under an argon atmosphere for another 12 h. After cooling to room temperature, the mixture was poured into 100 mL water, yellow precipitate was filtered off and washed with water, ethanol and ether. The crude product was purified by silica column chromatography with dichloromethane/petroleum ether (1:2, v/v) as the eluent to give 0.29 g Ir(ppy)2pbi as a yellow powder. Yield: 47.5percent, 0.14 g. Ir(ppy)3 can also be obtained as a byproduct, yield: 27.5percent. 1HNMR (CDCl3, 600MHz): 7.90 (t, J=6.4Hz, 2H), 7.85 (d, J=4.8Hz, 1H), 7.77 (d, J=5.4Hz, 1H), 7.69?7.59 (m, 7H), 7.50?7.47 (m, 2H), 7.06 (t, J=7.8Hz, 1H), 6.97 (d, J=7.8Hz, 1H), 6.92?6.78 (m, 10H), 6.72 (t, J=7.8Hz, 1H), 6.63 (d, J=7.8Hz, 1H), 6.53 (t, J=7.8Hz, 1H), 6.05 (d, J=8.4Hz, 1H); 13CNMR (CDCl3, 150MHz): 167.65, 166.68, 163.39, 162.61, 161.33, 148.06, 144.33, 143.92, 140.86, 137.90, 137.85, 136.91, 136.87, 136.32, 135.90, 135.80, 134.10, 130.38, 130.13, 129.89, 129.78, 129.74, 128.53, 128.17, 125.25, 123.94, 123.72, 123.23, 122.38, 122.00, 121.29, 119.66, 119.52, 119.09, 118.66, 118.54, 115.23, 110.53; HRMS (APCI): m/z calcd for C41H29IrN4: 770.2021; found: 771.2094 (M+H)+.
 

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