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2-Methoxypropene → (S)-1-[P-(Benzyloxy)phenoxy]-3-(isopropylamino)propan-2-OL

HRID 2417976
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HRID 2417976 반응식
[CH2:1]([O:8][C:9]1[CH:27]=[CH:26][C:12]([O:13][CH2:14][C@@H:15]([OH:25])[CH2:16][N:17]([CH:22]([CH3:24])[CH3:23])S(C)(=O)=O)=[CH:11][CH:10]=1)[C:2]1[CH:7]=[CH:6][CH:5]=[CH:4][CH:3]=1.COC(C)=C.P(Cl)(Cl)(Cl)=O.[H-].COCCO[Al+]OCCOC.[Na+].[H-]>C1(C)C=CC=CC=1.C(N(CC)CC)C>[CH2:1]([O:8][C:9]1[CH:10]=[CH:11][C:12]([O:13][CH2:14][C@@H:15]([OH:25])[CH2:16][NH:17][CH:22]([CH3:23])[CH3:24])=[CH:26][CH:27]=1)[C:2]1[CH:3]=[CH:4][CH:5]=[CH:6][CH:7]=1
참가 물질실험 절차후처리출처 및 근거반응 노트

참가 물질

7

반응물 4

HCID 83002-Methoxypropene2회HCID 24813Phosphorus oxychlorideHCID 12952555(S)-1-(4-benzyloxyphenoxy)-3-[N-mesyl-(1-methylethyl)amino]-2-propanolHCID 21584525Sodium bis(2-methoxyethoxy)aluminiumhydride

생성물 1

HCID 12941036(S)-1-[P-(Benzyloxy)phenoxy]-3-(isopropylamino)propan-2-OL수율 86.7%

시약·촉매·용매 2

HCID 1140Toluene용매2회HCID 8471Triethylamine용매

실험 절차

To a stirred slurry of (S)-1-(4-benzyloxyphenoxy)-3-[N-mesyl-(1-methylethyl)amino]-2-propanol (78.7 g) in 300 ml toluene was added isopropenyl methyl ether (29 ml) followed by 0.1 ml phosphorus oxychloride. The reaction mixture was stirred for 2 hours at room temperature to ensure formation of the isopropenyl methylether derivative, whereupon 1 ml of triethylamine was added to neutralize the acid catalyst. The solution was then added dropwise over 30 minutes to a stirred solution of sodium bis-(2-methoxyethoxy) aluminum hydride (70% in benzene; 286 ml) and 300 ml toluene which was maintained at 80° throughout the addition. After stirring for an additional 2 hours at 80°, the reaction was cooled and excess reagent was destroyed by the dropwise addition of 30 ml 2N sodium hydroxide and when the reaction had subsided, 300 ml 2N sodium hydroxide were added. The layers were separated and the organic layer was washed in turn with 1N sodium hydroxide (2×) and with brine (2×). The toluene layer was then diluted with ether (300 ml) and extracted using 800 ml 0.5N hydrochloric acid. The acidic extract was washed with ether and the organic layers were backwashed with 0.5N hydrochloric acid (100 ml). The stirred aqueous extracts were basified using 100 ml 10N sodium hydroxide and the resulting solids were removed by filtration and dried. Crystallization of the crude material from ethyl acetate-hexane furnished 54.7 g of (S)-1-(4-benzyloxyphenoxy)-3-(1-methylethyl)amino-2-propanol, mp 94°-96°.

후처리

  1. temperaturewas maintained at 80° throughout the addition
  2. stirringAfter stirring for an additional 2 hours at 80°
  3. temperaturethe reaction was cooled
  4. customexcess reagent was destroyed by the dropwise addition of 30 ml 2N sodium hydroxide and when the reaction
  5. addition300 ml 2N sodium hydroxide were added
  6. customThe layers were separated
  7. washthe organic layer was washed in turn with 1N sodium hydroxide (2×) and with brine (2×)
  8. additionThe toluene layer was then diluted with ether (300 ml)
  9. extractionextracted
  10. extractionThe acidic extract
  11. washwas washed with ether
  12. customthe resulting solids were removed by filtration
  13. customdried
  14. customCrystallization of the crude material from ethyl acetate-hexane

출처 및 근거

ORD 기록
ord-fd9a4fd4bfb0415289f00c4f84d1bbfb
출처 데이터셋
uspto-grants-1984_09
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US04471116

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