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2-Chloro-5-nitropyridine → Ethyl 2-[(5-nitro-2-pyridinyl)amino]-1,3-oxazole-5-carboxylate

HRID 490
ノート
印刷プレビュー

反応式

HRID 490 の反応式
CCOC(=O)c1cnc(N)o1.O=[N+]([O-])c1ccc(Cl)nc1>C1COCCO1.CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.O=C(/C=C/c1ccccc1)/C=C/c1ccccc1.O=C(/C=C/c1ccccc1)/C=C/c1ccccc1.O=C(/C=C/c1ccccc1)/C=C/c1ccccc1.O=C([O-])[O-].[Cs+].[Cs+].[Pd].[Pd]>CCOC(=O)c1cnc(Nc2ccc([N+](=O)[O-])cn2)o1
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 783082-Chloro-5-nitropyridineHCID 5260193Ethyl 2-amino-1,3-oxazole-5-carboxylate

生成物 1

HCID 60149030Ethyl 2-[(5-nitro-2-pyridinyl)amino]-1,3-oxazole-5-carboxylate収率 85.62%

試薬・触媒・溶媒 4

HCID 10796Cesium carbonate試薬HCID 6360441,1'-(9,9-Dimethyl-9H-xanthene-4,5-diyl)bis(1,1-diphenylphosphine)
触媒
HCID 9811564Bis(dibenzylideneacetone)palladium触媒
HCID 312751,4-Dioxane溶媒

反応条件

温度
160 °C

実験手順

Objective: Test of substrate scope in couple of ester substituted aminooxazole To an oven-dried microwave vial was added ethyl 2-aminooxazole-5-carboxylate (156 mg, 1.00 mmol), cesium carbonate (651 mg, 2.00 mmol), TRIS(DIBENZYLIDENEACETONE)DIPALLADIUM(0) (22.87 mg, 0.02 mmol) 2-chloro-5-nitropyridine (158 mg, 1.00 mmol) and (9,9-dimethyl-9H-xanthene-4,5-diyl)bis(diphenylphosphine) (43.4 mg, 0.07 mmol) and the vial was capped and purged with nitrogen. dioxane (4 mL) (degassed) was added and the reaction mixture was heated to 160 °C for 1 h under microwave irradiation. LCMS of the crude reaction mixture indicated that the desired product had been formed while only a trace of the amine starting material remained. DCM (20 mL) was added to the crude reaction mixture together with silica (2 g) and the solvent was removed under reduced pressure. The resulting residue was then placed in a dry-load tube prior to chromatography. The crude product was purified by flash silica chromatography, elution gradient 0 to 2.5% methanolic ammonia in DCM. Pure fractions were evaporated to dryness to afford ethyl 2-(5-nitropyridin-2-ylamino)oxazole-5-carboxylate (238 mg, 86 %) as a orange solid.

出典と根拠

ORDレコード
ord-99625d03cee6403dbb604294d8ab8a9b
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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