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5-Bromo-2-methoxybenzonitrile → (R)-5-(2-(tert-butyldimethylsilyloxy)propylamino)-2-methoxybenzonitrile

HRID 306
ノート
印刷プレビュー

反応式

HRID 306 の反応式
COc1ccc(Br)cc1C#N.C[C@H](CN)O[Si](C)(C)C(C)(C)C>CC(=O)O.CC(=O)O.CC(C)c1cc(C(C)C)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1.Cc1ccccc1.O=C([O-])[O-].[Cs+].[Cs+].[Pd]>COc1ccc(NC[C@@H](C)O[Si](C)(C)C(C)(C)C)cc1C#N
参加物反応条件実験手順出典と根拠反応ノート

参加物

7

反応物 2

HCID 44185605-Bromo-2-methoxybenzonitrileHCID 59302513(R)-2-(tert-butyldimethylsilyloxy)propan-1-amine

生成物 1

HCID 58464488(R)-5-(2-(tert-butyldimethylsilyloxy)propylamino)-2-methoxybenzonitrile収率 47.64%

試薬・触媒・溶媒 4

HCID 10796Cesium carbonate試薬HCID 4144353Palladium (II) acetate触媒
HCID 11155794
2-Dicyclohexylphosphino-2',4',6'-triisoprophylbiphenyl
触媒
HCID 1140Toluene溶媒

反応条件

温度
120 °C

実験手順

PdOAc2 (0.529 g, 2.36 mmol) and dicyclohexyl(2',4',6'-triisopropylbiphenyl-2-yl)phosphine (1.124 g, 2.36 mmol) were added in one portion to a degassed solution of 5-bromo-2-methoxybenzonitrile (5 g, 23.58 mmol), (R)-2-(tert- butyldimethylsilyloxy)propan-1-amine (5.36 g, 28.30 mmol) and cesium carbonate (11.52 g, 35.37 mmol) in toluene (100 mL) at 20°C under nitrogen. The resulting suspension was stirred at 120 °C for 50 hours. The reaction mixture was diluted with EtOAc (150 mL) and water (150 mL) and the biphasic mixture was filtered through celite. The organic layer was separated and washed sequentially with water (150 mL) and saturated brine (150 mL). The organic layer was evaporated to afford crude product. The crude product was purified by flash silica chromatography, elution gradient 0 to 20% EtOAc in isohexane. Pure fractions were evaporated to dryness to afford (R)-5-(2-(tert- butyldimethylsilyloxy)propylamino)-2-methoxybenzonitrile (3.60 g, 47.6 %) as a pale yellow oil.

出典と根拠

ORDレコード
ord-3a15989581314d86a106f9d713384402
出典データセット
750 AstraZeneca ELN dataset
元リンク
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反応ノート

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