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1,2-Dichloroethane → N-[2-tert-butoxy-5-(trifluoromethyl)benzyl]-1-(1-hydroxyethyl)-3-oxocyclopentanecarboxamide

HRID 643543
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HRID 643543 반응식
[OH:1][CH:2]([C:4]1([C:10]([OH:12])=O)[CH2:8][CH2:7][C:6](=[O:9])[CH2:5]1)[CH3:3].ON1C2N=CC=CC=2N=N1.C(Cl)CCl.[C:27]([O:31][C:32]1[CH:37]=[CH:36][C:35]([C:38]([F:41])([F:40])[F:39])=[CH:34][C:33]=1[CH2:42][NH2:43])([CH3:30])([CH3:29])[CH3:28]>C(Cl)Cl>[C:27]([O:31][C:32]1[CH:37]=[CH:36][C:35]([C:38]([F:39])([F:40])[F:41])=[CH:34][C:33]=1[CH2:42][NH:43][C:10]([C:4]1([CH:2]([OH:1])[CH3:3])[CH2:8][CH2:7][C:6](=[O:9])[CH2:5]1)=[O:12])([CH3:30])([CH3:28])[CH3:29]
참가 물질실험 절차후처리출처 및 근거반응 노트

참가 물질

6

반응물 4

HCID 111,2-DichloroethaneHCID 181649HOAtHCID 431536542-Tert-butoxy-5-trifluoromethyl-benzylamineHCID 578805271-(1-Hydroxyethyl)-3-oxocyclopentanecarboxylic acid

생성물 1

HCID 59261003N-[2-tert-butoxy-5-(trifluoromethyl)benzyl]-1-(1-hydroxyethyl)-3-oxocyclopentanecarboxamide

시약·촉매·용매 1

HCID 6344
Dichloromethane
용매
3회

실험 절차

A mixture of 1-(1-hydroxyethyl)-3-oxocyclopentanecarboxylic acid (3.54 g, 20.6 mmol), 1-hydroxy-7-azabenzotriazole (4.14 g, 30.9 mmol), and EDC (5.92 g, 30.9 mmol) in 70 mL of DCM was stirred at rt for 10 min then 1-[2-tert-butoxy-5-(trifluoromethyl)phenyl]methanamine (5.08 g, 20.6 mmol) was added in 10 mL of DCM. The resulting mixture was stirred at rt for 50 min, then was diluted with DCM and washed with water followed by brine. The organic layer was dried over anhydrous MgSO4, filtered, and concentrated. Purification by MPLC (silica, 85% ethyl acetate/hexanes) provided N-[2-tert-butoxy-5-(trifluoromethyl)benzyl]-1-(1-hydroxyethyl)-3-oxocyclopentanecarboxamide as a mixture of threo and erythro enantiomer pairs.

후처리

  1. stirringThe resulting mixture was stirred at rt for 50 min
  2. washwashed with water
  3. dry with materialThe organic layer was dried over anhydrous MgSO4
  4. filtrationfiltered
  5. concentrationconcentrated
  6. customPurification by MPLC (silica, 85% ethyl acetate/hexanes)

출처 및 근거

ORD 기록
ord-4d192067a34d4df8b80b8f72dfcf92a7
출처 데이터셋
uspto-grants-2010_04
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US07700591B2

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