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Chemical Structure| 1083009-44-2 Chemical Structure| 1083009-44-2
Chemical Structure| 1083009-44-2

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5,5-Difluoro-2,8-diiodo-1,3,7,9-tetramethyl-10-phenyl-5H-dipyrrolo[1,2-c:2',1'-f][1,3,2]diazaborinin-4-ium-5-ude is a complex organic compound containing fluorine and iodine atoms, potentially used in high-performance fluorescent probes and bioimaging applications, with significant optical properties.

4.5 *For Research Use Only !

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Product Details of 5,5-Difluoro-2,8-diiodo-1,3,7,9-tetramethyl-10-phenyl-5H-dipyrrolo[1,2-c:2',1'-f][1,3,2]diazaborinin-4-ium-5-uide

CAS No. :1083009-44-2
Formula : C19H17BF2I2N2
M.W : 575.97
SMILES Code : CC1C(=C([N-]2[B+3]([N]3=C(C(=C(C3=C(C3C=CC=CC=3)C2=1)C)I)C)([F-])[F-])C)I
MDL No. :N/A
InChI Key :DLDOADVXWJCBOG-UHFFFAOYSA-N
Pubchem ID :71723181

Safety of 5,5-Difluoro-2,8-diiodo-1,3,7,9-tetramethyl-10-phenyl-5H-dipyrrolo[1,2-c:2',1'-f][1,3,2]diazaborinin-4-ium-5-uide

GHS Pictogram:
Signal Word:Warning
Hazard Statements:H302-H315-H319-H335
Precautionary Statements:P261-P280-P301+P312-P302+P352-P305+P351+P338

Application In Synthesis of 5,5-Difluoro-2,8-diiodo-1,3,7,9-tetramethyl-10-phenyl-5H-dipyrrolo[1,2-c:2',1'-f][1,3,2]diazaborinin-4-ium-5-uide

* 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 [ 1083009-44-2 ]

[ 1083009-44-2 ] Synthesis Path-Downstream   1~1

  • 1
  • [ 267221-88-5 ]
  • [ 1083009-44-2 ]
  • C55H45BF2N4 [ No CAS ]
YieldReaction ConditionsOperation in experiment
86% With tris-(dibenzylideneacetone)dipalladium(0); potassium carbonate; tri tert-butylphosphoniumtetrafluoroborate; In tetrahydrofuran; water; at 60℃; for 24h;Inert atmosphere; General procedure: Under an argon atmosphere, a mixture of 3 (1 eq.) and 5 (4 eq.) inTHF was charged with K2CO3 (6 eq.) dissolved in water. Next, the solutionwas degassed using argon for 15 min, then Pd2dba3 (0.1 eq.) and[(t-Bu)3PH]BF4 (0.4 eq.) were added to the system and was stirred at60 C for 24 h based on the TLC analysis. After cooling to room temperature,the solvent was removed under reduced pressure and thecrude resulting was purified by column chromatography on silica gelusing hexane/CH2Cl2 (1:9) as the eluent to afford the derivativesBTPAI, BTPAII, BTPAIII and BTPAIV.2.6.1. BTPAIYield 86%, 35 mg. 1H NMR (400 MHz, CHCl3-d) 4/ppm=7.51-7.46(m, 3H), 7.37-7.34 (m, 2H), 7.29-7.27 (m, 2H), 7.25 (d, J=7.5 Hz,6H), 7.13-7.09 (m, 8H), 7.08-7.05 (m, 4H), 7.04-6.99 (m, 8H), 2.57 (s,6H), 1.33 (s, 6H). 13C NMR (100 MHz, CHCl3-d) 4/ppm=147.7, 143.4,136.4, 134.9, 130.9, 130.5, 129.3, 129.2, 129.0, 128.4, 125.5, 124.5,123.0, 13.5, 12.9. (MALDI-TOF): m/z calcd for [C55H45BF2N4]+:810.80; found: 810.376. Anal. Calcd for C55H45BF2N4: C, 81.48; H,5.59; N, 6.91%. Found: C, 81.44; H, 5.53; N, 6.89%.
 

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