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1-[3-(3,4-Dichloro-benzyloxy)-phenyl]-ethanone → 2-Bromo-1-[3-(3,4-dichloro-benzyloxy)-phenyl]-ethanone

HRID 708609
Notes
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Reaction equation

HRID 708609 reaction equation
[Cl:1][C:2]1[CH:3]=[C:4]([CH:16]=[CH:17][C:18]=1[Cl:19])[CH2:5][O:6][C:7]1[CH:8]=[C:9]([C:13](=[O:15])[CH3:14])[CH:10]=[CH:11][CH:12]=1.C1CNC(=O)C1.[Br:26][Br-]Br>CO.C(Cl)Cl>[Br:26][CH2:14][C:13]([C:9]1[CH:10]=[CH:11][CH:12]=[C:7]([O:6][CH2:5][C:4]2[CH:16]=[CH:17][C:18]([Cl:19])=[C:2]([Cl:1])[CH:3]=2)[CH:8]=1)=[O:15]
ParticipantsProcedureWorkupSources & evidenceReaction notes

Participants

3

Reactant 1

HCID 288256531-[3-(3,4-Dichloro-benzyloxy)-phenyl]-ethanone

Product 1

HCID 583275612-Bromo-1-[3-(3,4-dichloro-benzyloxy)-phenyl]-ethanone

Reagents, catalysts & solvents 1

HCID 21226129Dichloromethane methanolSolvent

Procedure

1-[3-(3,4-Dichloro-benzyloxy)-phenyl]-ethanone (30 g) was dissolved in MeOH:DCM (2:1, 300 mL) and pyrolidone hydrotribromide (75 g) was added portion wise and stirred at room temperature for 3 hours. After completion of the reaction, the mixture was concentrated in vacuo and poured into saturated sodium bicarbonate solution (200 mL) and extracted with ethyl acetate (2×200 mL). The organic extracts were combined and washed with brine and concentrated in vacuo. Then this residue was dissolved in DCM (75 mL) and product was precipitated by slow addition of methanol (75 mL), filtered and dried in vacuum (29 g). 1H NMR (400 MHz, CDCl3): 7.62-7.54 (m, 3H), 7.47 (d, 1H), 7.42 (t, 1H), 7.25-7.30 (m, 1H), 7.18-7.23 (m, 1H), 5.07 (s, 2H), 4.44 (s, 2H).

Workup

  1. customAfter completion of the reaction
  2. concentrationthe mixture was concentrated in vacuo
  3. additionpoured into saturated sodium bicarbonate solution (200 mL)
  4. extractionextracted with ethyl acetate (2×200 mL)
  5. washwashed with brine
  6. concentrationconcentrated in vacuo
  7. dissolutionThen this residue was dissolved in DCM (75 mL)
  8. customproduct was precipitated by slow addition of methanol (75 mL)
  9. filtrationfiltered
  10. customdried in vacuum (29 g)

Sources & evidence

ORD record
ord-7e36f6793360479bb20ac7cbe54ebed3
Source dataset
uspto-grants-2015_11
DOI
10.6084/m9.figshare.5104873.v1
Patent number
US09175003B2

Reaction notes

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On this pageParticipantsProcedureWorkupSources & evidenceReaction notes