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4-Bromoanisole → 4-methoxy-N-(oxan-4-ylmethyl)aniline

HRID 536
ノート
印刷プレビュー

反応式

HRID 536 の反応式
COc1ccc(Br)cc1.NCC1CCOCC1>CC(=O)O.CC(=O)O.CC(C)(C)[O-].CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.Cc1ccccc1.[Na+].[Pd]>COc1ccc(NCC2CCOCC2)cc1
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 77304-BromoanisoleHCID 27732104-Aminomethyltetrahydropyran

生成物 1

HCID 623858534-methoxy-N-(oxan-4-ylmethyl)aniline収率 22.82%

試薬・触媒・溶媒 4

HCID 23676156Sodium t-butoxide試薬HCID 6360441,1'-(9,9-Dimethyl-9H-xanthene-4,5-diyl)bis(1,1-diphenylphosphine)触媒
HCID 4144353
Palladium (II) acetate
触媒
HCID 1140Toluene溶媒

反応条件

温度
80 °C

実験手順

Palladium (II) acetate (0.090 g, 0.40 mmol) and (9,9-dimethyl-9H-xanthene-4,5-diyl)bis(diphenylphosphine) (0.464 g, 0.80 mmol) were suspended in toluene (3 mL). The mixture was evacuated and purged with nitrogen, and warmed to 50°C. In a separate vessel, 1-bromo-4-methoxybenzene (1 g, 5.35 mmol), (tetrahydro-2H-pyran-4-yl)methanamine (0.654 mL, 5.35 mmol) and sodium-t- butoxide (0.771 g, 8.02 mmol) were suspended in toluene (7 mL). The resulting mixture was evacuated, purged with nitrogen and warmed to 50°C. After ~30 mins, the catalyst mixture was transferred to the reaction vessel. The reaction was evacuated and purged with nitrogen and heated at 80°C overnight. The mixture was diluted with water (250 mL), and extracted with ethyl acetate (200 mL). The organic was dried over MgSO4, filtered and evaporated to afford crude product. The crude product was purified by ion exchange chromatography, using an SCX column. The desired product was eluted from the column using 7M NH3/MeOH and crude fractions were evaporated to dryness to afford 4-methoxy-N-((tetrahydro-2H-pyran-4-yl)methyl)aniline (0.270 g, 22.82 %) as a brown oil.

出典と根拠

ORDレコード
ord-c4dfba23f3204e1a90cbbf5ad1b6ca0b
出典データセット
750 AstraZeneca ELN dataset
元リンク
出典を表示

反応ノート

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