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Chemical Structure| 6905-07-3 Chemical Structure| 6905-07-3

Structure of 6905-07-3

Chemical Structure| 6905-07-3

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Product Details of [ 6905-07-3 ]

CAS No. :6905-07-3
Formula : C5H6ClN3O2
M.W : 175.57
SMILES Code : O=[N+](C1=CN=C(CCl)N1C)[O-]
MDL No. :MFCD21336639

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Application In Synthesis of [ 6905-07-3 ]

* 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 [ 6905-07-3 ]

[ 6905-07-3 ] Synthesis Path-Upstream   1~1

  • 1
  • [ 1073-72-9 ]
  • [ 6905-07-3 ]
  • [ 59729-37-2 ]
YieldReaction ConditionsOperation in experiment
60% With caesium carbonate; potassium iodide In acetonitrile at 80℃; Inert atmosphere General procedure: Method C: 2-Chloromethyl-1-methyl-5-nitro-1H-imidazol (6a) (1 g, 5.7 mmol), Cs2CO3 (6.6 g, 34.2 mmol) and KI (0.095 g, 0.57 mmol) were stirred in MeCN under inert atmosphere. p-Hydroxyphenyl methyl sulfide (0.8 g, 5.7 mmol) in MeCN was added via a pressure equalized dropping funnel. The mixture was reflux at 80 °C overnight under inert atmosphere. The reaction mixture was filtered and the solvent evaporated. The residue was dissolved in CHCl3 and washed with 10percent K2CO3 (3 x 15 mL). The organic layer was collected, dried over MgSO4, concentrated to give crude in the form of yellow oil. Purification of product 7a (0.95 g, 60percent) was done by the same procedure as described in method A.
References: [1] Bioorganic and Medicinal Chemistry Letters, 2011, vol. 21, # 3, p. 1015 - 1018.
 

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