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Tributylamine → 2H-1-Benzopyran-2-one, 4-chloro-6-methoxy-

HRID 1490256
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HRID 1490256 반응식
O[C:2]1[C:11]2[C:6](=[CH:7][CH:8]=[C:9]([O:12][CH3:13])[CH:10]=2)[O:5][C:4](=[O:14])[CH:3]=1.O=P(Cl)(Cl)[Cl:17].C(N(CCCC)CCCC)CCC>C1(C)C=CC=CC=1>[Cl:17][C:2]1[C:11]2[C:6](=[CH:7][CH:8]=[C:9]([O:12][CH3:13])[CH:10]=2)[O:5][C:4](=[O:14])[CH:3]=1
참가 물질실험 절차후처리출처 및 근거반응 노트

참가 물질

5

반응물 3

HCID 7622TributylamineHCID 24813Phosphorus oxychlorideHCID 546765304-Hydroxy-6-methoxy-2H-1-benzopyran-2-one

생성물 1

HCID 110850882H-1-Benzopyran-2-one, 4-chloro-6-methoxy-수율 64%

시약·촉매·용매 1

HCID 1140Toluene용매

실험 절차

A stirred mixture of 4-hydroxy-6-methoxycoumarin (116 g, 0.603 mole) and POCl3 (462.29 g, 3.015 mole) in toluene is treated dropwise with tri-n-butylamine (250 mL, 1.73 mole) at 25° C., heated at 100°-110° C. and monitored by HPLC analysis. When the reaction is complete, the mixture is cooled to room temperature, poured over ice, stirred mechanically for about 2 hours and filtered. The filtercake is washed with water and toluene, dissolved in methylene chloride and filtered through diatomaceous earth. The methylene chloride filtrate is concentrated and treated with a mixture of dimethylformamide and acetonitrile to afford crystallization. The mixture is filtered to give the title product, 81.7 g, (64% yield) identified by HPLC analysis.

후처리

  1. temperatureheated at 100°-110° C.
  2. additionpoured over ice
  3. filtrationfiltered
  4. washThe filtercake is washed with water and toluene
  5. dissolutiondissolved in methylene chloride
  6. filtrationfiltered through diatomaceous earth
  7. concentrationThe methylene chloride filtrate is concentrated
  8. additiontreated with a mixture of dimethylformamide and acetonitrile
  9. customto afford
  10. customcrystallization
  11. filtrationThe mixture is filtered

출처 및 근거

ORD 기록
ord-9f6a767d6fd04900b9e8fa4990e521f3
출처 데이터셋
uspto-grants-1997_10
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US05681968

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