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Chemical Structure| 1386861-46-6 Chemical Structure| 1386861-46-6

Structure of 1386861-46-6

Chemical Structure| 1386861-46-6

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Product Details of [ 1386861-46-6 ]

CAS No. :1386861-46-6
Formula : C14H12ClNO
M.W : 245.70
SMILES Code : O=C(NC1=CC=CC=C1)C2=C(C)C=CC=C2Cl
English Name :2-Chloro-6-methyl-N-phenylbenzamide
MDL No. :MFCD25459278
InChI Key :CPCKYTVKZDZSBA-UHFFFAOYSA-N
Pubchem ID :58009020

Safety of [ 1386861-46-6 ]

Application In Synthesis of [ 1386861-46-6 ]

* 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 [ 1386861-46-6 ]

[ 1386861-46-6 ] Synthesis Path-Downstream   1~2

  • 2
  • [ 1386861-46-6 ]
  • [ 115186-37-3 ]
  • [ 2055766-88-4 ]
YieldReaction ConditionsOperation in experiment
88% Stage #1: 2-chloro-6-methyl-N-phenylbenzamide With n-butyllithium In tetrahydrofuran at -30℃; for 1h; Stage #2: tert-butyl (2S)-2-[N-methoxy(N-methyl)amino]carbonyl}pyrrolidine-1-carboxylate In tetrahydrofuran 11.1 Step 1: Preparation of tert-butyl (S)-2-(2-(3-chloro-2-(phenylcarbamoyl)phenyl)acetyl)pyrrolidine-1-carboxylate 6 g (24.42 mmol) of 2-chloro-6-methyl-N-phenylbenzamide prepared in step 2 of Preparative Example 13 was dissolved in anhydrous THF (50 mL). 24.42 ml (61.05 mmol, 2.5 equivalent) of n-BuLi was slowly added thereto at -30° C., followed by stirring for 1 hour. 9.46 g (36.63 mmol, 1.5 equivalent) of tert-butyl (S)-2-(methoxy(methyl)carbamoyl)pyrrolidine-1-carboxylate was dissolved in anhydrous THF (50 mL), which was slowly added to the reaction mixture above. Then, 5.05 g of the target compound tert-butyl (S)-2-(2-(3-chloro-2-(phenylcarbamoyl)phenyl)acetyl)pyrrolidine-1-carboxylate was obtained as a white solid by the same manner as described in step 3 of Preparative Example (11.41 mmol, yield: 88%). 1H NMR(300 MHz, CDCl3) δ 8.03 (s, 1H), 7.60 (d, J=6.9 Hz, 2H), 7.32-7.38 (m, 3H), 7.16 (d, J=8.6 Hz, 2H), 7.05 (d, J=4.1 Hz, 1H), 4.28-4.39 (m, 1H), 3.98 (s, 1H), 3.41-3.52 (m, 2H), 1.69-1.78 (m, 4H), 1.38 (d, J=12.1 Hz, 9H).
 

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