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Sodium borohydride → HCID 58859730、化合物

HRID 1785914
ノート
印刷プレビュー

反応式

HRID 1785914 の反応式
[CH2:1]([O:8][C:9](=[O:23])[NH:10][C:11](=O)[CH2:12][C@@H:13]([NH:15][C:16]1[CH:21]=[CH:20][CH:19]=[CH:18][CH:17]=1)[CH3:14])[C:2]1[CH:7]=[CH:6][CH:5]=[CH:4][CH:3]=1.[BH4-].[Na+]>C(O)C>[CH2:1]([O:8][C:9](=[O:23])[NH:10][C@H:11]1[C:21]2[C:16](=[CH:17][CH:18]=[CH:19][CH:20]=2)[NH:15][C@@H:13]([CH3:14])[CH2:12]1)[C:2]1[CH:7]=[CH:6][CH:5]=[CH:4][CH:3]=1
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

4

反応物 2

HCID 4311764Sodium borohydrideHCID 58859791(S)-(3-Phenylamino-butyryl)-carbamic Acid Benzyl Ester

生成物 1

HCID 58859730HCID 58859730、化合物収率 94%

試薬・触媒・溶媒 1

HCID 702Ethanol溶媒

反応条件

温度
-10 °C

実験手順

A clean, dry flask was charged with (S)-(3-phenylamino-butyryl)-carbamic acid benzyl ester (0.821 g, 2.63 mmol) followed by reagent grade ethanol (20 mL) and cooled to −10° C. Sodium borohydride (0.070 g, 1.84 mmol) was added to the solution in one portion. Nitrogen gas purging is maintained for 5 minutes. A solution of 3.3 M aqueous magnesium chloride solution (0.561 g MgCl2 6H2O in 1.5 mL water) was added at such a rate that the internal temperature did not exceed −5° C. Once addition was completed, the reaction solution was warmed to 0° C. for 30 min. The reaction was quenched with methylene chloride (10 mL), and 1 M hydrochloric acid/citric acid solution (10.52 mL 1 N HCl, and 1.38 g citric acid). This bilayer was stirred at room temperature for six hours. The reaction mixture was diluted with ethyl acetate (200 mL) and neutralized with sat. aqueous NaHCO3 solution (pH=10). The organics were collected together and washed with sat. NaCl solution and dried over Na2SO4, filtered and concentrated. Flash chromatography using an Isco system (100% hexane to 50% EtOAc/50% hexane gradient) afforded the title compound (0.733 g). (91%).

後処理

  1. customA clean, dry flask
  2. customNitrogen gas purging
  3. temperatureis maintained for 5 minutes
  4. additionA solution of 3.3 M aqueous magnesium chloride solution (0.561 g MgCl2 6H2O in 1.5 mL water) was added at such a rate that the internal temperature
  5. customdid not exceed −5° C
  6. additionOnce addition
  7. temperaturethe reaction solution was warmed to 0° C. for 30 min
  8. customThe reaction was quenched with methylene chloride (10 mL), and 1 M hydrochloric acid/citric acid solution (10.52 mL 1 N HCl, and 1.38 g citric acid)
  9. additionThe reaction mixture was diluted with ethyl acetate (200 mL)
  10. customThe organics were collected together
  11. washwashed with sat. NaCl solution
  12. dry with materialdried over Na2SO4
  13. filtrationfiltered
  14. concentrationconcentrated

出典と根拠

ORDレコード
ord-78c8ee5d4b2b4815abd0fa19411ab3ed
出典データセット
uspto-grants-2009_03
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US07504508B2

反応ノート

読み込み中…

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