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Triphenylphosphine → (R)-2-((2-methoxy-4-nitrophenoxy)methyl)oxirane

HRID 1916361
ノート
印刷プレビュー

反応式

HRID 1916361 の反応式
[CH:1]1C=CC(P(C2C=CC=CC=2)C2C=CC=CC=2)=CC=1.[N+:20]([C:23]1[CH:24]=[C:25]([OH:31])[C:26]([O:29][CH3:30])=[CH:27][CH:28]=1)([O-:22])=[O:21].[CH2:32]1[O:34][C@H:33]1CO>C1COCC1>[CH3:1][O:31][C:25]1[CH:24]=[C:23]([N+:20]([O-:22])=[O:21])[CH:28]=[CH:27][C:26]=1[O:29][CH2:30][C@H:33]1[CH2:32][O:34]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 3

HCID 11776TriphenylphosphineHCID 694712-Methoxy-5-nitrophenolHCID 6973630(-)-Glycidol

生成物 1

HCID 59168988(R)-2-((2-methoxy-4-nitrophenoxy)methyl)oxirane収率 72%

試薬・触媒・溶媒 1

HCID 8028Tetrahydrofuran溶媒2 回

実験手順

To a solution of Ph3P (23.3 g; 88.7 mmol) in 450 mL of THF cooled to 0° C. was added a solution of di-t-butylazodicarboxylate (20.4 g; 88.7 mmol) in 50 ml of THF over 15 min. After stirring at 0° C. for 10 min 4-nitroguaiacol (10.0 g; 59.1 mmol) was added followed by (S)-glycidol (6.3 mL; 94.6 mmol) over 10 min and the mixture allowed to warm to rt and stir for 2 h. The solution was concentrated and the residue dissolved in EtOAc, washed with H2O and brine, dried over anhydrous MgSO4, filtered and the filtrate concentrated under reduced pressure. The residue was purified by flash chromatography (silica gel, Hexanes/EtOAc; 100:0 to 1:3 gradient). Impure fractions were concentrated under reduced pressure and the residue further purified by flash chromatography (silica gel, Hexanes/EtOAc; 100:0 to 0:100 gradient). Pure fractions from both purifications were combined and concentrated under reduced pressure to afford 9.58 g (72%) of the title compound as a yellow solid. 1H NMR (CDCl3) δ 2.78-2.80 (m, 1H), 2.94-2.96 (m, 1H), 3.40-3.43 (m, 1H), 3.96 (s, 3H), 4.06-4.11 (m, 1H), 4.41-4.44 (m, 1H), 6.98 (d, J=8.79 Hz, 1H), 7.75 (d, J=2.20 Hz, 1H), 7.89 (dd, J=8.79 Hz, 2.19 Hz, 1H); 13C NMR (CDCl3) δ 28.20, 44.57, 49.75, 56.28, 70.17, 106.80, 111.71, 117.50, 141.92, 149.20, 153.38; HPLC (Method #1) 2.09 min retention time; LCMS (ES): m/z 226 [M+H]+.

後処理

  1. additionwas added
  2. concentrationThe solution was concentrated
  3. dissolutionthe residue dissolved in EtOAc
  4. washwashed with H2O and brine
  5. dry with materialdried over anhydrous MgSO4
  6. filtrationfiltered
  7. concentrationthe filtrate concentrated under reduced pressure
  8. customThe residue was purified by flash chromatography (silica gel, Hexanes/EtOAc; 100:0 to 1:3 gradient)
  9. concentrationImpure fractions were concentrated under reduced pressure
  10. customthe residue further purified by flash chromatography (silica gel, Hexanes/EtOAc; 100:0 to 0:100 gradient)
  11. concentrationconcentrated under reduced pressure

出典と根拠

ORDレコード
ord-44b730356cf148b5b5e79e770ef34350
出典データセット
uspto-grants-2013_12
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US08618115B2

反応ノート

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