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Diethyl Ether → 3-(3,4-Dichlorophenyl)propan-1-amine hydrochloride

HRID 1053671
ノート
印刷プレビュー

反応式

HRID 1053671 の反応式
[Cl:1][C:2]1[CH:3]=[C:4]([CH2:9][CH2:10][CH2:11][NH:12]C(=O)OC(C)(C)C)[CH:5]=[CH:6][C:7]=1[Cl:8].CCOCC>Cl.O1CCOCC1>[ClH:1].[Cl:1][C:2]1[CH:3]=[C:4]([CH2:9][CH2:10][CH2:11][NH2:12])[CH:5]=[CH:6][C:7]=1[Cl:8]
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 2

HCID 3283Diethyl EtherHCID 86731075HCID 86731075、化合物

生成物 1

HCID 717443353-(3,4-Dichlorophenyl)propan-1-amine hydrochloride収率 142.3%

試薬・触媒・溶媒 2

HCID 313Hydrochloric Acid溶媒HCID 312751,4-Dioxane溶媒

実験手順

To a solution of Intermediate 1A (8.0 g, 37 mmol) in THF (35 mL) was added LAH (40 mL, 2 M in THF, 81 mmol) dropwise for 40 min at 0° C. under Ar. The colorless solution turned yellowish brown, and a precipitate formed after stirring at rt for 30 min. The suspension was stirred at rt for 6 h. The reaction mixture was cooled to 0° C. and quenched by careful addition of H2O (3 mL), 15% NaOH (3 mL) and then H2O (9 mL). Et2O (ca. 100 mL) was added. The mixture was stirred at rt for 20 min then filtered through Celite® and rinsed with Et2O (ca. 150 mL). The filtrate was concentrated. The residue was dissolved in Et2O (100 mL) and CH2Cl2 (10 mL), dried over Na2SO4, filtered and concentrated to give a light tan oil after drying under vacuum. This crude was taken to the next step without further purification. LC-MS: 203.9 (M+H), RT=2.76 min (Method A). TEA (8.36 mL, 60.0 mmol) was added to 3-(3,4-dichlorophenyl)propan-1-amine (6.8 g, 33 mmol) in THF (100 mL) followed by the addition of di-tert-butyl dicarbonate (8.22 g, 37.6 mmol) and the reaction mixture was stirred at rt for 16 h. The solvent was removed under vacuum and Et2O was added. The organic solution was washed with H2O and then brine. The organic layer was dried over MgSO4, filtered and concentrated. The residue was purified by flash chromatography using hexanes/EtOAc to give the product tert-butyl 3-(3,4-dichlorophenyl)propylcarbamate (6.9 g, 23 mmol, 68% yield) as a colorless oil. LC-MS (ESI) 248.0 (M-tBu+H), RT=3.85 min (Method A). tert-Butyl 3-(3,4-dichlorophenyl)propylcarbamate (3.48 g, 11.4 mmol) was stirred in 4N HCl in dioxane (20 mL) at rt for 2 h. The volume of the mixture was reduced under reduced pressure, and Et2O was added. The reaction mixture was stirred at rt for 30 min. The resulting precipitate was filtered and rinsed with Et2O to give Intermediate 1 (1.95 g, 8.11 mmol, 70.9% yield). LCMS=203.9 [M+1], RT=1.51 min (Method B).

後処理

  1. additionwas added
  2. filtrationThe resulting precipitate was filtered
  3. washrinsed with Et2O

出典と根拠

ORDレコード
ord-ce419fe10a7446ac8712e911e3574569
出典データセット
uspto-grants-2016_07
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US09394260B2

反応ノート

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