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Dichloromethane → Ethyl 5-methoxythiazole-2-carboxylate

HRID 872538
ノート
印刷プレビュー

反応式

HRID 872538 の反応式
[CH3:1][O:2][C:3](=O)[CH2:4][NH:5][C:6](=O)[C:7]([O:9][CH2:10][CH3:11])=[O:8].P12(SP3(SP(SP(S3)(S1)=S)(=S)S2)=S)=[S:15].C(Cl)Cl>C(Cl)(Cl)Cl>[CH3:1][O:2][C:3]1[S:15][C:6]([C:7]([O:9][CH2:10][CH3:11])=[O:8])=[N:5][CH:4]=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 6344DichloromethaneHCID 14817Phosphorus sulfide (P2S5)HCID 3413524Ethyl 2-(2-methoxy-2-oxoethylamino)-2-oxoacetate

生成物 1

HCID 67169140Ethyl 5-methoxythiazole-2-carboxylate収率 7.4%

試薬・触媒・溶媒 1

HCID 6212Chloroform溶媒

反応条件

温度
60 °C

実験手順

A mixture of ethyl 2-(2-methoxy-2-oxoethylamino)-2-oxoacetate (1.00 g, 5.29 mmol) and phosphorus pentasulfide (1.29 g, 5.82 mmol) in chloroform (20 ml) was stirred at 60° C. for 7 h. To the cooled reaction mixture DCM (100 ml) was added and the mixture was washed with water (50 ml) and brine (50 ml). Organic phase was dried over Na2SO4 and evaporated. Evaporation residual was dissolved in dry MeCN (10 ml) and phosphorus pentoxide (0.75 g, 5.29 mml) was added and the mixture was heated to reflux for 4.5 h. To the cooled reaction mixture water (35 ml) was added and the mixture was extracted with EtOAc (3×50 ml). Combined organic fractions were dried over Na2SO4 and evaporated to give crude product, which was purified twice by CombiFlash (1st column: silica, eluent: 0-100% EtOAc in heptane; 2nd column: C-18, eluent: 0-100% MeCN in water) to yield 73 mg (7%) of the title compound. 1H-NMR (400 MHz; CDCl3): δ 1.42 (t, 3H), 4.01 (s, 3H), 4.43 (q, 2H), 7.30 (s, 1H).

後処理

  1. additionwas added
  2. washthe mixture was washed with water (50 ml) and brine (50 ml)
  3. dry with materialOrganic phase was dried over Na2SO4
  4. customevaporated
  5. customEvaporation residual
  6. dissolutionwas dissolved in dry MeCN (10 ml)
  7. additionphosphorus pentoxide (0.75 g, 5.29 mml) was added
  8. temperaturethe mixture was heated
  9. temperatureto reflux for 4.5 h
  10. customTo the cooled reaction mixture water (35 ml)
  11. additionwas added
  12. extractionthe mixture was extracted with EtOAc (3×50 ml)
  13. dry with materialCombined organic fractions were dried over Na2SO4
  14. customevaporated
  15. customto give crude product, which
  16. customwas purified twice by CombiFlash (1st column: silica, eluent: 0-100% EtOAc in heptane; 2nd column: C-18, eluent: 0-100% MeCN in water)

出典と根拠

ORDレコード
ord-4263836c96bb4f2d8a4337928e947507
出典データセット
uspto-grants-2015_03
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US08975254B2

反応ノート

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