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Chemical Structure| 6324-50-1 Chemical Structure| 6324-50-1

Structure of 6324-50-1

Chemical Structure| 6324-50-1

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Product Details of [ 6324-50-1 ]

CAS No. :6324-50-1
Formula : C6H2Cl3I
M.W : 307.34
SMILES Code : IC1=C(Cl)C=C(Cl)C=C1Cl
MDL No. :MFCD00052857
InChI Key :XXFFSBRDPQFIPO-UHFFFAOYSA-N
Pubchem ID :232054

Safety of [ 6324-50-1 ]

GHS Pictogram:
Signal Word:Warning
Hazard Statements:H302-H315-H319-H335
Precautionary Statements:P261-P301+P312-P302+P352-P304+P340-P305+P351+P338

Application In Synthesis of [ 6324-50-1 ]

* 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.

  • Upstream synthesis route of [ 6324-50-1 ]
  • Downstream synthetic route of [ 6324-50-1 ]

[ 6324-50-1 ] Synthesis Path-Upstream   1~1

  • 1
  • [ 6324-50-1 ]
  • [ 557-21-1 ]
  • [ 6575-05-9 ]
YieldReaction ConditionsOperation in experiment
84% With tetrakis(triphenylphosphine) palladium(0) In N,N-dimethyl-formamide at 85℃; Add l-iodo-2,4,6-trichlorobenzene (1500 mg, 4.88 mmol), zinc cyanide (345 mg, 2.94 mmol) and tetrakis(triphenylphosphine)palladium(0) (282 mg, 0.244 mmol) to anhydrous DMF (30 mL). Heat to 85 0C overnight. Cool to room temperature, dilute with toluene, wash with 2 N ammonium hydroxide (3x) and saturated aqueous sodium chloride and concentrate. Purify by silica gel chromatography, eluting with EPO <DP n="75"/>hexanes/dichloromethane to give 2,4,6-trichlorobenzonitrile (850 mg, 84percent): 1HNMR (400 MHz, CDCl3) δ 7.76 (s, IH), 7.65 (s, IH).
References: [1] Patent: WO2006/44454, 2006, A1, . Location in patent: Page/Page column 73-74.
 

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