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Benzamidine, hydrochloride → HCID 22386595、化合物

HRID 1067486
ノート
印刷プレビュー

反応式

HRID 1067486 の反応式
F[C:2]1[CH:9]=[CH:8][CH:7]=[C:6]([O:10][C:11]2[CH:16]=[CH:15][CH:14]=[CH:13][CH:12]=2)[C:3]=1[C:4]#[N:5].Cl.[C:18]([NH2:26])(=[NH:25])[C:19]1[CH:24]=[CH:23][CH:22]=[CH:21][CH:20]=1.C([O-])(=O)C.[Na+]>CN(C)C(=O)C>[NH2:5][C:4]1[C:3]2[C:2](=[CH:9][CH:8]=[CH:7][C:6]=2[O:10][C:11]2[CH:16]=[CH:15][CH:14]=[CH:13][CH:12]=2)[N:26]=[C:18]([C:19]2[CH:24]=[CH:23][CH:22]=[CH:21][CH:20]=2)[N:25]=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

5

反応物 3

HCID 80289Benzamidine, hydrochlorideHCID 517045Sodium AcetateHCID 27374532-fluoro-6-phenoxybenzonitrile

生成物 1

HCID 22386595HCID 22386595、化合物収率 12.3%

試薬・触媒・溶媒 1

HCID 31374Dimethylacetamide溶媒

反応条件

温度
150 °C

実験手順

A mixture of 2-fluoro-6-phenoxybenzonitrile (2.7 g, 13 mmol), benzamidine hydrochloride (Aldrich) (3.0 g, 19 mmol) and sodium acetate (1.6 g, 19 mmol) in 60 ml of N,N-dimethylacetamide was heated at 150° C. under nitrogen for 6.5 hours. After cooling to room temperature the reaction mixture was evaporated under reduced pressure. The product was suspended in 20 ml of ethanol and water (100 ml) and concentrated ammonium hydroxide (10 ml) was added. The precipitate was isolated by filtration, washed with water, dried and recrystallized twice from 60 ml of 2-propanol at 4° C. The precipitate was collected by filtration, washed with 2-propanol and dried at 50° C. in vacuo to give 4-amino-2-phenyl-5-phenoxyquinazoline (0.5 g, 12%, m.p. 190-191° C.):

後処理

  1. temperatureAfter cooling to room temperature the reaction mixture
  2. customwas evaporated under reduced pressure
  3. additionwater (100 ml) and concentrated ammonium hydroxide (10 ml) was added
  4. customThe precipitate was isolated by filtration
  5. washwashed with water
  6. customdried
  7. customrecrystallized twice from 60 ml of 2-propanol at 4° C
  8. filtrationThe precipitate was collected by filtration
  9. washwashed with 2-propanol
  10. customdried at 50° C. in vacuo

出典と根拠

ORDレコード
ord-d5c49d7d92964d64adc7a7aae71dcb94
出典データセット
uspto-grants-2001_06
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US06248771B1

反応ノート

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