1-Chloro-4-isocyanato-2-(trifluoromethyl) benzene → HCID 118223454, compound

HRID 2200201Notes

Reaction equation

HRID 2200201 reaction equation
[NH2:1][C:2]1[CH:3]=[C:4]([CH:18]=[CH:19][C:20]=1[F:21])[O:5][C:6]1[N:11]=[CH:10][N:9]=[C:8]([NH:12][C:13]([CH:15]2[CH2:17][CH2:16]2)=[O:14])[CH:7]=1.[Cl:22][C:23]1[CH:28]=[CH:27][C:26]([N:29]=[C:30]=[O:31])=[CH:25][C:24]=1[C:32]([F:35])([F:34])[F:33]>C1COCC1.C(Cl)Cl>[Cl:22][C:23]1[CH:28]=[CH:27][C:26]([NH:29][C:30]([NH:1][C:2]2[CH:3]=[C:4]([CH:18]=[CH:19][C:20]=2[F:21])[O:5][C:6]2[N:11]=[CH:10][N:9]=[C:8]([NH:12][C:13]([CH:15]3[CH2:17][CH2:16]3)=[O:14])[CH:7]=2)=[O:31])=[CH:25][C:24]=1[C:32]([F:33])([F:34])[F:35]

Participants

5

Reactant 2

HCID 27332651-Chloro-4-isocyanato-2-(trifluoromethyl) benzeneHCID 90020626HCID 90020626, compound

Product 1

HCID 118223454HCID 118223454, compoundYield 77%

Reagents, catalysts & solvents 2

HCID 6344DichloromethaneSolventHCID 8028TetrahydrofuranSolvent

Procedure

Dissolve N-[6-(3-amino-4-fluoro-phenoxy)pyrimidin-4-yl]cyclopropanecarboxamide (400 mg, 1.4 mmol) in THF (4 mL) and DCM (10 mL), add 4-chloro-3-(trifluoromethyl)phenyl isocynate (1.4 g, 6.3 mmol). Stir the reaction at room temperature overnight. Filter and collect the solid to get the title compound (545 mg, 77%). MS: (M+1): 510.2.

Workup

  1. customthe reaction at room temperature overnight
  2. filtrationFilter
  3. customcollect the solid

Sources & evidence

ORD record
ord-b4f3fc557fef4028b07584a198745311
Source dataset
uspto-grants-2016_06
Patent number
US09359338B2

Reaction notes

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