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Ammonium Hydroxide → 5-Bromo-2-iodobenzamide

HRID 1985104
Notes
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Reaction equation

HRID 1985104 reaction equation
[Br:1][C:2]1[CH:3]=[CH:4][C:5]([I:11])=[C:6]([CH:10]=1)[C:7](O)=[O:8].C[N:13](C(ON1N=NC2C=CC=NC1=2)=[N+](C)C)C.F[P-](F)(F)(F)(F)F.[Cl-].[NH4+].[OH-].[NH4+]>CN(C)C=O.ClCCl>[Br:1][C:2]1[CH:3]=[CH:4][C:5]([I:11])=[C:6]([CH:10]=1)[C:7]([NH2:13])=[O:8]
ParticipantsProcedureWorkupSources & evidenceReaction notes

Participants

7

Reactant 4

HCID 14923Ammonium HydroxideHCID 25517Ammonium ChlorideHCID 3029395-Bromo-2-iodobenzoic acidHCID 9886157Methanaminium, N-((dimethylamino)(3H-1,2,3-triazolo(4,5-b)pyridin-3-yloxy)methylene)-N-methyl-, hexafluorophosphate(1-) (1:1)

Product 1

HCID 404287815-Bromo-2-iodobenzamideYield 72.2%

Reagents, catalysts & solvents

2
HCID 6228DimethylformamideSolventHCID 6344DichloromethaneSolvent

Procedure

To 5-bromo-2-iodobenzoic acid (20 g, 61.2 mmol) in 1:1 mixture of dichloromethane and dimethylformamide (200 mL) was added HATU (25 g, 65.8 mmol), and the solution stirred 2 min. Excess ammonium chloride (20 g) was added, and the heterogeneous mixture was stirred 1 h. Ammonium hydroxide (20 mL) was added causing a white precipitate. The precipitate was filtered and washed with ethyl acetate. The solution was diluted with ethyl acetate, washed with water, 1 N hydrochloric acid, saturated sodium bicarbonate, and saturated sodium chloride, dried (magnesium sulfate), filtered, and concentrated under reduced pressure resulting in the formation of a white precipitate. The solid was filtered to provide the title compound (14.4 g). ESI MS m/z 327.0 [M+H]+.

Workup

  1. stirringthe heterogeneous mixture was stirred 1 h
  2. filtrationThe precipitate was filtered
  3. washwashed with ethyl acetate
  4. additionThe solution was diluted with ethyl acetate
  5. washwashed with water, 1 N hydrochloric acid, saturated sodium bicarbonate, and saturated sodium chloride
  6. dry with materialdried (magnesium sulfate)
  7. filtrationfiltered
  8. concentrationconcentrated under reduced pressure
  9. customresulting in the formation of a white precipitate
  10. filtrationThe solid was filtered

Sources & evidence

ORD record
ord-159ac17c4a4140aca3883559a4d6a49c
Source dataset
uspto-grants-2009_06
DOI
10.6084/m9.figshare.5104873.v1
Patent number
US07544717B2

Reaction notes

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On this pageParticipantsProcedureWorkupSources & evidenceReaction notes