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p-Toluenesulfonic acid → 2,2-Dimethyl-4(tol-4-yl)-6-bromo-thiochrom-3-ene

HRID 1862738
ノート
印刷プレビュー

反応式

HRID 1862738 の反応式
Br[C:2]1[CH:7]=[CH:6][C:5]([CH3:8])=[CH:4][CH:3]=1.[Li]C(C)(C)C.CCCCC.[CH3:19][C:20]1([CH3:32])[CH2:29][C:28](=O)[C:27]2[C:22](=[CH:23][CH:24]=[C:25]([Br:31])[CH:26]=2)[S:21]1.CC1C=CC(S(O)(=O)=O)=CC=1>C1COCC1.ClCCl.C(OC(=O)C)C>[CH3:19][C:20]1([CH3:32])[CH:29]=[C:28]([C:2]2[CH:7]=[CH:6][C:5]([CH3:8])=[CH:4][CH:3]=2)[C:27]2[C:22](=[CH:23][CH:24]=[C:25]([Br:31])[CH:26]=2)[S:21]1
参加物実験手順後処理出典と根拠反応ノート

参加物

9

反応物 5

HCID 6101p-Toluenesulfonic acidHCID 78054-BromotolueneHCID 8003PentaneHCID 222183176-Bromo-2,2-dimethylthiochroman-4-one2 回HCID 178418306HCID 178418306、化合物

生成物 1

HCID 861914872,2-Dimethyl-4(tol-4-yl)-6-bromo-thiochrom-3-ene

試薬・触媒・溶媒 3

HCID 6344Dichloromethane溶媒
HCID 8028Tetrahydrofuran溶媒2 回
HCID 8857Ethyl Acetate溶媒

実験手順

To a cold (−78° C.) solution of 4-bromotoluene (720 mg, 4.2 mmol) in THF (8 mL) was added t-BuLi in pentane (1.7M, 0.5 mL, 0.85 mmol). The mixture was warmed to ambient temperature over 30 minutes with stirring. This mixture was added to a flask containing 2,2-dimethyl-6-bromo-thiochroman-4-one (Compound M, 140 mg, 0.4 mmol) and THF (2 mL). and stirred for 16 hours at ambient temperature. The reaction was quenched by adding aq. NH4Cl, and the resulting mixture was extracted with ethylacetate, washed with brine, dried and the solvent was removed by evaporation. The product was isolated by chromatography on silica gel. The material was dissolved in dichloromethane (5 mL) and pTSA (5 mg) was added and heated to 50° C. for 3 hours. The mixture was diluted with ethylacetate (20 mL), washed with 10% NaHCO3 (5 mL), brine (5 mL), dried with MgSO4 and the solvent was removed by evaporation to afford the title compound as an oil.

後処理

  1. additionThis mixture was added to a flask
  2. stirringand stirred for 16 hours at ambient temperature
  3. customThe reaction was quenched
  4. additionby adding aq. NH4Cl
  5. extractionthe resulting mixture was extracted with ethylacetate
  6. washwashed with brine
  7. customdried
  8. customthe solvent was removed by evaporation
  9. customThe product was isolated by chromatography on silica gel
  10. temperatureheated to 50° C. for 3 hours
  11. washwashed with 10% NaHCO3 (5 mL), brine (5 mL)
  12. dry with materialdried with MgSO4
  13. customthe solvent was removed by evaporation

出典と根拠

ORDレコード
ord-848b0f97679a49e8ab446dd52cffa06e
出典データセット
uspto-grants-2003_03
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US06538149B1

反応ノート

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