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Dichloromethane → 1-Tetralone

HRID 1985100
ノート
印刷プレビュー

反応式

HRID 1985100 の反応式
[CH2:1]([Mg]Br)[C:2]([CH3:5])([CH3:4])C.Cl[CH2:9]Cl.O1[CH2:15][CH2:14][O:13]C1.O1C[CH2:19][CH2:18][CH2:17]1>[Cl-].[Zn+2].[Cl-]>[C:14]1(=[O:13])[C:5]2[C:2](=[CH:1][CH:17]=[CH:18][CH:19]=2)[CH2:4][CH2:9][CH2:15]1
参加物実験手順後処理出典と根拠反応ノート

参加物

6

反応物 4

HCID 6344DichloromethaneHCID 8028TetrahydrofuranHCID 125861,3-DioxolaneHCID 178445863HCID 178445863、化合物

生成物 1

HCID 107241-Tetralone収率 99%

試薬・触媒・溶媒 1

HCID 3007855Zincchloride触媒

実験手順

A solution of the neo-pentylmagnesium bromide prepared above (60 mL) was added dropwise at room temperature over 20 min to a solution of zinc chloride (60 mL, 0.5 M in tetrahydrofuran, 30.0 mmol). Following Grignard addition, the reaction mixture was stirred for 0.5 h to yield a white heterogenous suspension. [1,1′-Bis(diphenylphosphino)ferrocene]dichloropalladium(II) complex with dichloromethane (1:1) (816 mg, 1.0 mmol) was added in one portion followed by dropwise addition of a solution of the dioxolane prepared in step 1 (2.69 g, 10.0 mmol) in tetrahydrofuran (10 mL) to yield a yellow reaction mixture, which was then heated at reflux for 1 h to yield a brown solution. The reaction mixture was cooled to room temperature and carefully quenched with 10% hydrochloric acid (100 mL) and the reaction mixture was stirred at room temperature overnight. The reaction mixture was diluted with diethyl ether and the phases separated. The organic phase was then washed with water, saturated sodium chloride, dried (sodium sulfate), filtered, and concentrated under reduced pressure to yield a black oil. Purification by flash column chromatography (silica, 19:1 hexanes/ethyl acetate) afforded compound (4) (2.17 g, 99%) as a yellow oil: IR (ATR) 3359, 2957, 1762, 1686, 1521, 1236, 1126, 1076, 1053, 1028 cm−1; 1H NMR (300 MHz, CDCl3) δ 7.79 (s, 1H), 7.26-7.22 (m, 1H), 7.15 (m, 1H), 2.96-2.92 (m, 2H), 2.67-2.62 (m, 2H), 2.50 (s, 2H), 2.17-2.08 (m, 2H), 0.89 (s, 9H); ESI MS m/z 217 [C15H20O+H]+; HPLC: (Method D)>99% (AUC), tR=13.30 min.

後処理

  1. additionFollowing Grignard addition
  2. customto yield a white heterogenous suspension
  3. customto yield a yellow reaction mixture, which
  4. temperaturewas then heated
  5. temperatureat reflux for 1 h
  6. customto yield a brown solution
  7. customcarefully quenched with 10% hydrochloric acid (100 mL)
  8. stirringthe reaction mixture was stirred at room temperature overnight
  9. additionThe reaction mixture was diluted with diethyl ether
  10. customthe phases separated
  11. washThe organic phase was then washed with water, saturated sodium chloride
  12. dry with materialdried (sodium sulfate)
  13. filtrationfiltered
  14. concentrationconcentrated under reduced pressure
  15. customto yield a black oil
  16. customPurification by flash column chromatography (silica, 19:1 hexanes/ethyl acetate)

出典と根拠

ORDレコード
ord-d141c0686cdf4c8ea43d313f437104a8
出典データセット
uspto-grants-2009_06
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US07544717B2

反応ノート

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