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Ammonium Chloride → 8-(4'-Ethoxy-2,2',3,3'-tetrafluoro-1,1'-biphenyl-4-yl)-1,4-dioxaspiro[4.5]decan-8-ol

HRID 2039383
ノート
印刷プレビュー

反応式

HRID 2039383 の反応式
[CH2:1]([O:3][C:4]1[CH:9]=[CH:8][C:7]([C:10]2[CH:15]=[CH:14][CH:13]=[C:12]([F:16])[C:11]=2[F:17])=[C:6]([F:18])[C:5]=1[F:19])[CH3:2].C([Li])(CC)C.[O:25]1[C:29]2([CH2:34][CH2:33][C:32](=[O:35])[CH2:31][CH2:30]2)[O:28][CH2:27][CH2:26]1.[Cl-].[NH4+]>C1COCC1>[CH2:1]([O:3][C:4]1[CH:9]=[CH:8][C:7]([C:10]2[CH:15]=[CH:14][C:13]([C:32]3([OH:35])[CH2:33][CH2:34][C:29]4([O:28][CH2:27][CH2:26][O:25]4)[CH2:30][CH2:31]3)=[C:12]([F:16])[C:11]=2[F:17])=[C:6]([F:18])[C:5]=1[F:19])[CH3:2]
参加物実験手順後処理出典と根拠反応ノート

参加物

6

反応物 4

HCID 25517Ammonium ChlorideHCID 5674151,4-Dioxaspiro[4.5]decan-8-oneHCID 58453709HCID 58453709、化合物HCID 178418400CID 53628100

生成物 1

HCID 674329368-(4'-Ethoxy-2,2',3,3'-tetrafluoro-1,1'-biphenyl-4-yl)-1,4-dioxaspiro[4.5]decan-8-ol

試薬・触媒・溶媒 1

HCID 8028
Tetrahydrofuran
溶媒
2 回

実験手順

4′-Ethoxy-2,2′,3,3′-tetrafluoro-1,1′-biphenyl (s75) (50.0 g) and THF (500 ml) were placed in a reaction vessel under an atmosphere of nitrogen, and cooled to −74° C. sec-Butyllithium (1.00 M; in n-hexane-cyclohexane; 222 ml) was added dropwise in the temperature range of −74° C. to −70° C., and the stirring was continued for another 2 hours. 1,4-Dioxaspiro[4.5]decan-8-one (s7) (28.8 g) in THF (200 ml) solution was added dropwise in the temperature range of −75° C. to −70° C., and the stirring was continued for another 8 hours while the mixture was allowed to come to 25° C. The reaction mixture was treated with an aqueous solution of ammonium chloride (3%), and the aqueous layer was extracted with ethyl acetate. The combined organic layers were washed with water, a saturated aqueous solution of sodium hydrogencarbonate and water, and then dried over anhydrous magnesium sulfate. Distillation of the solvent under reduced pressure gave 8-(4′-ethoxy-2,2′,3,3′-tetrafluoro-1,1′-biphenyl-4-yl)-1,4-dioxaspiro[4.5]decan-8-ol. The compound was mixed with p-toluenesulfonic acid (1.5 g) and toluene (300 ml), and the mixture was heated to reflux for 2 hours while distilled water was removed. After the reaction mixture had been cooled to 30° C., it was treated with water, and the aqueous layer was extracted with toluene. The combined organic layers were washed with a saturated aqueous solution of sodium hydrogencarbonate and water, and then dried over anhydrous magnesium sulfate. The solution was concentrated under reduced pressure, and the residue was purified by column chromatography with toluene as an eluent and silica gel as a stationary phase powder. The purified product was dissolved in a mixed solvent of toluene (100 ml) and Solmix A-11 (100 ml), to which Pd/C (2.5 g) was added. The mixture was stirred at room temperature under a hydrogen atmosphere until hydrogen absorption had ceased. After the reaction had been completed, Pd/C was removed, and then solvent was distilled off. The residue was purified by column chromatography with toluene as an eluent and silica gel as a stationary phase powder, and then by recrystallization from Solmix A-11 to give 8-(4′-ethoxy-2,2′,3,3′-tetrafluoro-1,1′-biphenyl-4-yl)-1,4-dioxaspiro[4.5]decane (s76) (31.9 g). The yield based on the compound (s75) was 42.0%.

後処理

  1. additionwas added dropwise in the temperature range of −74° C. to −70° C.
  2. waitthe stirring was continued for another 8 hours while the mixture
  3. customto come to 25° C
  4. extractionthe aqueous layer was extracted with ethyl acetate
  5. washThe combined organic layers were washed with water
  6. dry with materiala saturated aqueous solution of sodium hydrogencarbonate and water, and then dried over anhydrous magnesium sulfate
  7. distillationDistillation of the solvent under reduced pressure

出典と根拠

ORDレコード
ord-37d3823d1cb7408595cdd267e4552a11
出典データセット
uspto-grants-2013_11
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US08580146B2

反応ノート

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