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Toluene → HCID 86701437、化合物

HRID 2173902
ノート
印刷プレビュー

反応式

HRID 2173902 の反応式
[OH:1][C:2]1[CH:3]=[C:4]([CH:8]2[NH:13][CH2:12][CH2:11][N:10]([C:14]([O:16][C:17]([CH3:20])([CH3:19])[CH3:18])=[O:15])[CH2:9]2)[CH:5]=[CH:6][CH:7]=1.O[CH2:22][CH2:23][NH:24][C:25](=[O:34])[O:26][CH2:27][C:28]1[CH:33]=[CH:32][CH:31]=[CH:30][CH:29]=1.C(P(CCCC)CCCC)CCC.CCOC(/N=N/C(OCC)=O)=O.C1(C)C=CC=CC=1>C1COCC1.C([O-])(O)=O.[Na+]>[CH2:27]([O:26][C:25]([NH:24][CH2:23][CH2:22][O:1][C:2]1[CH:3]=[C:4]([CH:8]2[NH:13][CH2:12][CH2:11][N:10]([C:14]([O:16][C:17]([CH3:20])([CH3:19])[CH3:18])=[O:15])[CH2:9]2)[CH:5]=[CH:6][CH:7]=1)=[O:34])[C:28]1[CH:33]=[CH:32][CH:31]=[CH:30][CH:29]=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

8

反応物 5

HCID 1140TolueneHCID 13831TributylphosphineHCID 280458benzyl N-(2-hydroxyethyl)carbamateHCID 5462977Diethyl azodicarboxylateHCID 16740841Tert-butyl 3-(3-hydroxyphenyl)piperazine-1-carboxylate

生成物 1

HCID 86701437HCID 86701437、化合物

試薬・触媒・溶媒 2

HCID 8028Tetrahydrofuran溶媒
HCID 516892Sodium Bicarbonate溶媒

反応条件

温度
0 °C

実験手順

(+) or (−)-tert-butyl 3-(3-hydroxyphenyl)piperazine-1-carboxylate (tr=9.7 min) (Biological Example 2.1) (300 mg, 1.078 mmol) and benzyl 2-hydroxyethylcarbamate (210 mg, 1.078 mmol) were dissolved in THF (10 ml). Tributylphosphine (0.404 ml, 1.617 mmol) was added, and after cooling to 0° C., DEAD 40% in toluene (0.640 ml, 1.617 mmol) was added dropwise. The reaction was stirred for 2 h at 0° C., then overnight at rt. The reaction mixture was diluted with aqueous NaHCO3. The layers were separated and the aqueous layer was extracted with AcOEt. The organic phase dried over MgSO4 and concentrated in vacuum. The crude residue was purified by preparative HPLC (Macherey-Nagel Nucleosil 100-10 C18, CH3CN/H2O (0.1% TFA)) to give the title compound. MS (ESI+) m/z 455.2 (M+H).

後処理

  1. customovernight
  2. customat rt
  3. customThe layers were separated
  4. extractionthe aqueous layer was extracted with AcOEt
  5. dry with materialThe organic phase dried over MgSO4
  6. concentrationconcentrated in vacuum
  7. customThe crude residue was purified by preparative HPLC (Macherey-Nagel Nucleosil 100-10 C18, CH3CN/H2O (0.1% TFA))

出典と根拠

ORDレコード
ord-36dea08cbee04e1c926400742e09417b
出典データセット
uspto-grants-2015_06
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US09056874B2

反応ノート

読み込み中…

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