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Sodium Hydroxide → 4-bromo-2,3-dihydro-1H-isoindole

HRID 1511544
ノート
印刷プレビュー

反応式

HRID 1511544 の反応式
Cl.C([N:9]1[CH2:17][C:16]2[C:11](=[CH:12][CH:13]=[CH:14][C:15]=2[Br:18])[CH2:10]1)C1C=CC=CC=1.[OH-].[Na+].ClC(OC(Cl)=O)C>CCOC(C)=O>[Br:18][C:15]1[CH:14]=[CH:13][CH:12]=[C:11]2[C:16]=1[CH2:17][NH:9][CH2:10]2
参加物反応条件実験手順後処理出典と根拠反応ノート

参加物

5

反応物 3

HCID 14798Sodium HydroxideHCID 5213051-Chloroethyl chloroformateHCID 574311902-Benzyl-4-bromoisoindoline hydrochloride

生成物 1

HCID 147958704-bromo-2,3-dihydro-1H-isoindole収率 111.5%

試薬・触媒・溶媒 1

HCID 8857Ethyl Acetate溶媒

反応条件

温度
90 °C

実験手順

To a solution of 2-benzyl-4-bromoisoindoline hydrochloride (11 g, 30.96 mmol) in 200 mL EtOAc was added 1M NaOH (100 mL) and the mixture stirred for 30 min. The organic layer was separated, washed with brine, dried over anhydrous Na2SO4 and solvent evaporated to an oil which was azeotroped once with toluene (50 mL). The oil was dissolved in chlorobenzene (50 mL) and 4A molecular sieves (5 g) added to the stirred solution. After 10 min, 1-chloroethylchloroformate (5.6 mL, 51 mmol) was added dropwise over 5 min. The reaction mixture was then heated to 90° C. for 2 h, cooled to room temperature and filtered. The solids were washed with chlorobenzene (5 mL) and methanol (40 mL). The filtrate was heated to 70° C. for 1 h., allowed to cool and stirred at room temperature overnight. The solids were filtered, washed with chlorobenzene (2 mL) and hexane and dried to give 6.84 g of title compound. LRMS (ESI) m/z 198.1 [(M+H)+; calcd for C8H9BrN: 198.0].

後処理

  1. customThe organic layer was separated
  2. washwashed with brine
  3. dry with materialdried over anhydrous Na2SO4 and solvent
  4. customevaporated to an oil which
  5. customwas azeotroped once with toluene (50 mL)
  6. dissolutionThe oil was dissolved in chlorobenzene (50 mL)
  7. addition4A molecular sieves (5 g) added to the stirred solution
  8. waitAfter 10 min
  9. temperaturecooled to room temperature
  10. filtrationfiltered
  11. washThe solids were washed with chlorobenzene (5 mL) and methanol (40 mL)
  12. temperatureThe filtrate was heated to 70° C. for 1 h.
  13. temperatureto cool
  14. stirringstirred at room temperature overnight
  15. filtrationThe solids were filtered
  16. washwashed with chlorobenzene (2 mL) and hexane
  17. customdried

出典と根拠

ORDレコード
ord-f3f7178f30f249c88ae1284d29eeee8b
出典データセット
uspto-grants-2012_07
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US08216999B2

反応ノート

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