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Chemical Structure| 124627-86-7 Chemical Structure| 124627-86-7

Structure of 124627-86-7

Chemical Structure| 124627-86-7

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Product Details of [ 124627-86-7 ]

CAS No. :124627-86-7
Formula : C12H11F2N3O
M.W : 251.23
SMILES Code : CC1C(CN2N=CN=C2)(C3=CC=C(F)C=C3F)O1
MDL No. :MFCD09833867

Safety of [ 124627-86-7 ]

GHS Pictogram:
Signal Word:Warning
Hazard Statements:H302+H312+H332-H315-H319-H341
Precautionary Statements:P501-P261-P270-P202-P201-P271-P264-P280-P308+P313-P337+P313-P305+P351+P338-P362+P364-P332+P313-P301+P312+P330-P302+P352+P312-P304+P340+P312-P405

Application In Synthesis of [ 124627-86-7 ]

* 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 [ 124627-86-7 ]

[ 124627-86-7 ] Synthesis Path-Downstream   1~2

  • 1
  • [ 124627-86-7 ]
  • [ 97817-23-7 ]
  • 3-(2-amino-6,7-dihydro-4<i>H</i>-thiazolo[5,4-<i>c</i>]pyridin-5-yl)-2-(2,4-difluoro-phenyl)-1-[1,2,4]triazol-1-yl-butan-2-ol [ No CAS ]
  • 2
  • [ 13578-51-3 ]
  • [ 124627-86-7 ]
YieldReaction ConditionsOperation in experiment
43% (Example 32) (2R,3S)-2-(2,4-Difluorophenyl)-3-methyl-2-[(1H-1,2,4-triazol -1-yl)methyl]oxirane First, 0.21 g (5.10 mmol) of sodium hydride (60% content) was suspended in 3 mL of DMF, and the resulting suspension was cooled in ice. A solution of 0.53 g (2.19 mmol) of (2R,3R)-1-chloro-2-(2,4-difluorophenyl)butane-2,3-diolin 5 mL of DMF was added thereto, and stirring was performed for 1 hour. A solution of 0.64 g (2.85 mmol) of <strong>[13578-51-3]1-(p-toluenesulfonyl)-1,2,4-triazole</strong> and 0.06 g (0.88 mmol) of triazole in 3 mL of DMF was added, and the reaction solution was stirred at 60C for 3 hours. Then, the resulting solution was cooled to room temperature, and 10 mL of water was added to stop the reaction. The resulting product was extracted with ethyl acetate (20 mL * 2), and concentration was performed under reduced pressure. A quantitative analysis was performed by HPLC. Thereby, the title compound was obtained in a yield of 43% (HPLC conditions, column: CAPCELL PAK C18 TYPE MG manufactured by Shiseido Co. Ltd., mobile phase: acetonitrile/20 mM (potassium) phosphate buffer solution (pH = 2.5) = 2/8, flow rate: 1.0 mL/min, column temperature: 30C, detector: UV 210 nm, retention time: 37 minutes). 1H-NMR (400 MHz, CDCl3) delta: 1.64 (d, 3H, J = 5.6 Hz), 3.19 (q, 1H, J = 5.6 Hz), 4.42 (d, 1H, J = 14.6 Hz), 4.87 (d, 1H, J = 14.6 Hz), 6.69-6.80 (m, 2H), 6.98-7.03 (m, 1H), 7.81 (s, 1H), 7. 98 (s, 1H).
 

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