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Chemical Structure| 83558-09-2 Chemical Structure| 83558-09-2

Structure of 83558-09-2

Chemical Structure| 83558-09-2

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Product Details of [ 83558-09-2 ]

CAS No. :83558-09-2
Formula : C11H8ClFN2OS
M.W : 270.71
SMILES Code : O=C(NC1=NC(C2=CC=C(F)C=C2)=CS1)CCl
MDL No. :MFCD01315354
InChI Key :WZAPOTONSHTHMJ-UHFFFAOYSA-N
Pubchem ID :1133114

Safety of [ 83558-09-2 ]

GHS Pictogram:
Signal Word:Danger
Hazard Statements:H302-H315-H318-H335
Precautionary Statements:P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P310-P330-P332+P313-P362-P403+P233-P405-P501
Class:8
UN#:1759
Packing Group:

Application In Synthesis of [ 83558-09-2 ]

* 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 [ 83558-09-2 ]

[ 83558-09-2 ] Synthesis Path-Downstream   1~1

  • 1
  • [ 6096-89-5 ]
  • [ 83558-09-2 ]
  • [ 1048643-66-8 ]
YieldReaction ConditionsOperation in experiment
37% In 1,4-dioxane; for 16h;Heating / reflux; A mixture of 2-chloro-lambda/-[4-(4-fluorophenyl)thiazol-2-yl]acetamide (0.54 g, 2.00 mmol) and 4-fluorophenoxyethyl amine (0.37 g, 2.20 mmol) in dioxane (15.0 ml.) was heated at reflux for 16 h. After cooling to ambient temperature, the reaction solution was concentrated in vacuo. The residue was diluted with ethyl acetate (50.0 ml_), washed with water (3 x 25.0 ml_), dried over anhydrous sodium sulfate, and filtered. The filtrate was concentrated in vacuo to dryness. The residue was purified by column chromatography eluting with ethyl acetate in hexane (3:7) to afford 2-[2-(4- fluorophenoxy)ethylamino]-lambda/-[4-(4-fluorophenyl)thiazol-2-yl]acetamide (0.29 g, 37%) as a colourless solid: 1H NMR (300 MHz, DMSOd6) delta 12.00 (br, 1 H), 7.90 (dd, J = 7.2, 7.2 Hz, 2H), 7.57 (s, 1 H), 7.23 (dd, J = 8.7, 8.7 Hz, 2H), 7.08-6.95 (m, 3H), 4.06 (br, 1 H), 3.97 (t, J = 4.8 Hz, 2H), 3.76 (s, 2H), 3.50 (s, 2H), 3.10 (br, 1H); 13C NMR (75 MHz, DMSO-cfe) 8 171.4, 170.5, 163.9, 160.6, 158.1 , 1554, 148.2, 131.3 (d, 2JCF = 12 Hz), 128.1 (d, 2JcF = 33 Hz), 116.4-115.9 (m), 108.3, 68.6, 52.0, 48.2; MS (ES+) m/z 412 (M + 23), 390 (M + 1).
 

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