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Sodium hydride → 2-{[(5S)-5-(2,2-diethoxyethoxy)hex-2-yn-1-yl]oxy}tetrahydro-2H-pyran

HRID 1496781
ノート
印刷プレビュー

反応式

HRID 1496781 の反応式
[H-].[Na+].[O:3]1[CH2:8][CH2:7][CH2:6][CH2:5][CH:4]1[O:9][CH2:10][C:11]#[C:12][CH2:13][C@@H:14]([OH:16])[CH3:15].[CH2:17]([O:19][CH:20]([O:23][CH2:24][CH3:25])[CH2:21]I)[CH3:18]>O1CCCC1>[CH2:17]([O:19][CH:20]([O:23][CH2:24][CH3:25])[CH2:21][O:16][C@@H:14]([CH3:15])[CH2:13][C:12]#[C:11][CH2:10][O:9][CH:4]1[CH2:5][CH2:6][CH2:7][CH2:8][O:3]1)[CH3:18]
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 3

HCID 24758Sodium hydrideHCID 125047911,1-Diethoxy-2-iodoethane2 回HCID 86721312(2S)-6-(tetrahydro-2H-pyran-2-yloxy)hex-4-yn-2-ol

生成物 1

HCID 867213112-{[(5S)-5-(2,2-diethoxyethoxy)hex-2-yn-1-yl]oxy}tetrahydro-2H-pyran

試薬・触媒・溶媒 1

HCID 8028Tetrahydrofuran溶媒3 回

実験手順

Sodium hydride (60% in mineral oil, 9.8 g, 240 mmol) was added portion-wise to a 0° C. solution of (2S)-6-(tetrahydro-2H-pyran-2-yloxy)hex-4-yn-2-ol (synthesized as described by G. V. M. Sharma and K. Veera Babu, Tetrahedron: Asymmetry 2007, 18, 2175-2184) (27.0 g, 136 mmol) in tetrahydrofuran (130 mL), at a rate such that the reaction temperature remained below 5° C. After 5 minutes, the cooling bath was removed and the reaction mixture was allowed to stir at room temperature for 3.5 hours, whereupon it was again cooled to 0° C. A solution of 1,1-diethoxy-2-iodoethane (49.9 g, 204 mmol) in tetrahydrofuran (5 mL) was added drop-wise over 30 minutes, at a rate that maintained the reaction temperature below 10° C. After removal of the cooling bath, the reaction mixture was stirred at room temperature for 30 minutes, and then placed in a 50° C. oil bath for 90 minutes, at which time additional 1,1-diethoxy-2-iodoethane (3.3 g, 14 mmol) was added, as a solution in tetrahydrofuran (5 mL). Heating was continued for 1 hour, at which time the reaction mixture was cooled in an ice bath and quenched with a mixture of saturated aqueous ammonium chloride solution (210 mL) and saturated aqueous sodium chloride solution (210 mL). The resulting mixture was extracted with tert-butyl methyl ether (3×200 mL), and the combined organic layers were washed with saturated aqueous sodium chloride solution, dried over sodium sulfate, filtered, and concentrated in vacuo. Silica gel chromatography (Gradient: 0% to 50% ethyl acetate in hexanes) afforded the product as a yellow oil. Yield: 22.8 g, 72.5 mmol, 53%. 1H NMR (500 MHz, CDCl3), characteristic peaks: δ 4.80 (t, J=3.5 Hz, 1H), 4.59 (t, J=5.2 Hz, 1H), 4.28 (dt, half of ABX2 pattern, J=15.3, 2.1 Hz, 1H), 4.20 (dt, half of ABX2 pattern, J=15.3, 2.1 Hz, 1H), 3.81-3.87 (m, 1H), 2.48-2.56 (m, 1H), 2.28-2.36 (m, 1H), 1.78-1.88 (m, 1H), 1.69-1.77 (m, 1H), 1.25 (d, J=6.1 Hz, 3H), 1.22 (t, J=7.1 Hz, 6H).

後処理

  1. customremained below 5° C
  2. customthe cooling bath was removed
  3. temperaturewas again cooled to 0° C
  4. temperatureat a rate that maintained the reaction temperature below 10° C
  5. customAfter removal of the cooling bath
  6. stirringthe reaction mixture was stirred at room temperature for 30 minutes
  7. customplaced in a 50° C.
  8. customfor 90 minutes
  9. temperatureHeating
  10. waitwas continued for 1 hour, at which time
  11. temperaturethe reaction mixture was cooled in an ice bath
  12. customquenched with a mixture of saturated aqueous ammonium chloride solution (210 mL) and saturated aqueous sodium chloride solution (210 mL)
  13. extractionThe resulting mixture was extracted with tert-butyl methyl ether (3×200 mL)
  14. washthe combined organic layers were washed with saturated aqueous sodium chloride solution
  15. dry with materialdried over sodium sulfate
  16. filtrationfiltered
  17. concentrationconcentrated in vacuo

出典と根拠

ORDレコード
ord-b9da736f96134985938aa869a7c0439d
出典データセット
uspto-grants-2015_12
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US09198917B2

反応ノート

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