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Chemical Structure| 57616-69-0 Chemical Structure| 57616-69-0

Structure of 57616-69-0

Chemical Structure| 57616-69-0

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Product Details of [ 57616-69-0 ]

CAS No. :57616-69-0
Formula : C7H15Cl2N
M.W : 184.11
SMILES Code : Cl.ClCCCN1CCCC1
MDL No. :MFCD07787233
InChI Key :UUPCYQIIQHSPKR-UHFFFAOYSA-N
Pubchem ID :11571916

Safety of [ 57616-69-0 ]

GHS Pictogram:
Signal Word:Warning
Hazard Statements:H302-H315-H319-H335
Precautionary Statements:P261-P305+P351+P338

Application In Synthesis of [ 57616-69-0 ]

* 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 [ 57616-69-0 ]

[ 57616-69-0 ] Synthesis Path-Downstream   1~2

  • 1
  • [ 19748-66-4 ]
  • [ 57616-69-0 ]
  • 2
  • [ 52427-05-1 ]
  • [ 57616-69-0 ]
  • 1-[3-(2-bromo-5-nitrophenoxy)propyl]pyrrolidine [ No CAS ]
YieldReaction ConditionsOperation in experiment
79% With caesium carbonate; sodium iodide; In acetonitrile; at 80℃; for 5h; Into a 100-mL round-bottom flask, was placed <strong>[52427-05-1]2-bromo-5-nitrophenol</strong> (2 g, 9.17 mmol, 1 equiv), l-(3-chloropropyl)pyrrolidine hydrochloride (1.69 g, 9.18 mmol, 1 equiv), Nal (1.65 g, 1.20 equiv), Cs2CO3 (5.96 g, 18.29 mmol, 2.00 equiv), CH3CN (30 mL). The resulting solution was stirred for 5 h at 80 °C in an oil bath. The solids were filtered out. The resulting mixture was concentrated under vacuum. The residue was purified by flash chromatography with ACN/H20(28percent). This resulted in 2.4 g (79percent) of as a yellow solid. Analytical Data: LC-MS: (ES, m/z): RT = 0.964 min, LCMS33: m/z = 329 [M+l].
 

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