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Trifluoroacetic acid → 3-(1-Cyclopentyl-octahydro-pyrrolo[3,2-b]pyrrol-3-yl)-6-fluoro-1H-indole

HRID 1949624
ノート
印刷プレビュー

反応式

HRID 1949624 の反応式
C(OC([N:8]1[CH2:12][CH2:11][CH:10]2[N:13]([CH:26]3[CH2:30][CH2:29][CH2:28][CH2:27]3)[CH2:14][CH:15]([C:16]3[C:24]4[C:19](=[CH:20][C:21]([F:25])=[CH:22][CH:23]=4)[NH:18][CH:17]=3)[CH:9]12)=O)(C)(C)C.C(O)(C(F)(F)F)=O>C(Cl)Cl>[CH:26]1([N:13]2[CH2:14][CH:15]([C:16]3[C:24]4[C:19](=[CH:20][C:21]([F:25])=[CH:22][CH:23]=4)[NH:18][CH:17]=3)[CH:9]3[NH:8][CH2:12][CH2:11][CH:10]23)[CH2:30][CH2:29][CH2:28][CH2:27]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 6422Trifluoroacetic acidHCID 674082444-Cyclopentyl-6-(6-fluoro-1H-indol-3-yl)-hexahydro-pyrrolo[3,2-b]pyrrole-1-carboxylic acid tert-butyl ester

生成物 1

HCID 674097773-(1-Cyclopentyl-octahydro-pyrrolo[3,2-b]pyrrol-3-yl)-6-fluoro-1H-indole収率 93.1%

試薬・触媒・溶媒 1

HCID 6344Dichloromethane溶媒

反応条件

温度
0 °C

実験手順

A solution containing 36 (2.0 g, 4.8 mmol) in DCM (20 mL) was cooled to 0° C. TFA (6 mL) was added and the pink reaction mixture was stirred at 0° C. After 1 h, the reaction mixture was warmed to ambient temperature then concentrated in vacuo. The residue was dissolved in EtOAc and the organic solution was washed successively with saturated aqueous NaHCO3 and brine, dried over anhydrous Na2SO4, filtered, and concentrated to afford 1.4 g of 37 which was used without further purification. 1H NMR (CDCl3, 300 MHz): δ8.50 (br s, 1H), 7.58 (dd, J=5.4, 8.4 Hz, 1H), 7.05-7.01 (m, 2H), 6.92-6.85 (m, 1H), 4.17-4.11 (m, 1H), 3.92 (app q, J=6.0 Hz, 1H), 3.74 (app q, J=6.6 Hz, 1H), 3.21-3.15 (m, 1H), 3.08-2.88 (m, 3H), 2.75-2.67 (m, 2H), 1.96-1.78 (m, 5H), 1.61 (m, 4H) ppm. Mass spectrum, m/z [314.2] (M+H)+.

後処理

  1. temperaturethe reaction mixture was warmed to ambient temperature
  2. concentrationthen concentrated in vacuo
  3. dissolutionThe residue was dissolved in EtOAc
  4. washthe organic solution was washed successively with saturated aqueous NaHCO3 and brine
  5. dry with materialdried over anhydrous Na2SO4
  6. filtrationfiltered
  7. concentrationconcentrated

出典と根拠

ORDレコード
ord-e0bd399feedb429fac2c5c6b5200e27c
出典データセット
uspto-grants-2013_03
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US08399683B2

反応ノート

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