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Tetrabutylammonium Fluoride → 5-Benzyloxy-2-fluoromethyl-pyran-4-one

HRID 1187466
ノート
印刷プレビュー

反応式

HRID 1187466 の反応式
[CH2:1]([O:8][C:9]1[C:10](=[O:21])[CH:11]=[C:12]([CH2:15]OS(C)(=O)=O)[O:13][CH:14]=1)[C:2]1[CH:7]=[CH:6][CH:5]=[CH:4][CH:3]=1.[F-:22].C([N+](CCCC)(CCCC)CCCC)CCC>C(#N)C.C(OCC)(=O)C>[CH2:1]([O:8][C:9]1[C:10](=[O:21])[CH:11]=[C:12]([CH2:15][F:22])[O:13][CH:14]=1)[C:2]1[CH:7]=[CH:6][CH:5]=[CH:4][CH:3]=1
参加物実験手順後処理出典と根拠反応ノート

参加物

5

反応物 2

HCID 2724141Tetrabutylammonium Fluoride2 回HCID 84562570methanesulfonic acid 5-benzyloxy-4-oxo-4H-pyran-2-ylmethyl ester

生成物 1

HCID 866235005-Benzyloxy-2-fluoromethyl-pyran-4-one

試薬・触媒・溶媒 2

HCID 6342Acetonitrile溶媒2 回HCID 8857Ethyl Acetate溶媒

実験手順

To an ice/salt cooled solution of the sulfonate ester obtained in step 1 above ester (20.0 g, 64.4 mmol) in acetonitrile (120 mL) was added a mixture of a 75 wt % solution of tetrabutylammonium fluoride (35 g, 96.6 mmol) and 40 mL of acetonitrile. Additional tetrabutylammonium fluoride solution (35 g, 96.6 mmol) was added after 2.5 hrs and the reaction mixture was allowed to stir at room temperature for overnight. The reaction was concentrated in vacuo to give a dark red oil. The residue was diluted with 700 mL of ethyl acetate and washed 5 times with 120 mL of a 10% sodium hydrogen carbonate solution and twice with 120 mL of brine. The organic layer was dried over sodium sulfate, and concentrated to give a dark red oil. The crude product was purified by column chromatography on silica gel using a mixture of ethyl acetate and hexanes (1/1, v/v) as the eluant to give 5-benzyloxy-2-fluoromethyl-pyran-4-one as a waxy-like solid (10.0 g, 66% yield). 1H NMR (400 MHz, DMSO-D6) δ (ppm): 7.69 (s, 1H), 7.42-7.37 (m, 5H, H—Ar)), 6.57 (s, 1H), 5.36 (d, J=46.5 Hz, 2H, CFH2), 4.97 (m, 2H, OCH2).

後処理

  1. additionwas added
  2. concentrationThe reaction was concentrated in vacuo
  3. customto give a dark red oil
  4. washwashed 5 times with 120 mL of a 10% sodium hydrogen carbonate solution
  5. dry with materialThe organic layer was dried over sodium sulfate
  6. concentrationconcentrated
  7. customto give a dark red oil
  8. customThe crude product was purified by column chromatography on silica gel using
  9. additiona mixture of ethyl acetate and hexanes (1/1

出典と根拠

ORDレコード
ord-b5f8742ed69a439da580cde18c52e3e6
出典データセット
uspto-grants-2014_03
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US08673943B2

反応ノート

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