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Hydrochloric Acid → (2S)-1-(N-allyloxycarbonyl-N-methylaminoacetyl)-2-(2-methyl-3-oxo-1-butenyl)pyrrolidine

HRID 1090522
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HRID 1090522 반응식
P(Cl)(Cl)(Cl)=O.[CH2:6]([O:9][C:10]([N:12]([CH3:17])[CH2:13][C:14]([OH:16])=O)=[O:11])[CH:7]=[CH2:8].C(OC([N:24]1[CH2:28][CH2:27][CH2:26][C@H:25]1[CH:29]=[C:30]([CH3:34])[C:31](=[O:33])[CH3:32])=O)C=C.C1(P(C2C=CC=CC=2)C2C=CC=CC=2)C=CC=CC=1.CC1(C)CC(=O)CC(=O)C1.Cl>O1CCCC1.C1C=CC([P]([Pd]([P](C2C=CC=CC=2)(C2C=CC=CC=2)C2C=CC=CC=2)([P](C2C=CC=CC=2)(C2C=CC=CC=2)C2C=CC=CC=2)[P](C2C=CC=CC=2)(C2C=CC=CC=2)C2C=CC=CC=2)(C2C=CC=CC=2)C2C=CC=CC=2)=CC=1.O.C(OCC)(=O)C.C(O)(=O)C.CN(C)C=O>[CH2:6]([O:9][C:10]([N:12]([CH2:13][C:14]([N:24]1[CH2:28][CH2:27][CH2:26][C@H:25]1[CH:29]=[C:30]([CH3:34])[C:31](=[O:33])[CH3:32])=[O:16])[CH3:17])=[O:11])[CH:7]=[CH2:8]
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참가 물질

13

반응물 6

HCID 313Hydrochloric AcidHCID 11776TriphenylphosphineHCID 24813Phosphorus oxychlorideHCID 31358DimedoneHCID 19915028N-allyloxycarbonyl-N-methylglycineHCID 57093083(2S)-1-allyloxycarbonyl-2-(2-methyl-3-oxo-1-butenyl)pyrrolidine

생성물 1

HCID 57303820
(2S)-1-(N-allyloxycarbonyl-N-methylaminoacetyl)-2-(2-methyl-3-oxo-1-butenyl)pyrrolidine
수율 26.2%

시약·촉매·용매 6

HCID 178418397HCID 178418397, 화합물촉매HCID 176Acetic Acid용매HCID 962Water용매HCID 6228Dimethylformamide용매HCID 8028Tetrahydrofuran용매3회HCID 8857Ethyl Acetate용매

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온도
5 °C

실험 절차

To a mixture of dimethylformamide (4.2 ml) and tetrahydrofuran (10 ml) was added phosphorus oxychloride (4.2 ml) at 5° C. After stirring at 5° C. for 30 minutes, to the mixture were added successively tetrahydrofuran (60 ml) and N-allyloxycarbonyl-N-methylglycine (8.7 g). The mixture was stirred for 30 minutes at 5° C. (solution A). To a solution of (2S)-1-allyloxycarbonyl-2-(2-methyl-3-oxo-1-butenyl)pyrrolidine (10.0 g) in tetrahydrofuran (160 ml) were added successively triphenylphosphine (5.5 g), 5,5-dimethyl-1,3-cyclohexanedione (dimedone) (5.8 g), acetic acid (4.8 ml) and tetrakis(triphenylphosphine)palladium(0) (2.4 g). After stirring at ambient temperature for 30 minutes, the mixture was taken up into a mixture of ethyl acetate (100 ml) and water (100 ml). After adjusting to around pH 2 with 1N hydrochloric acid, the aqueous layer was separated, washed with ethyl acetate and tetrahydrofuran (200 ml) was added thereto. After adjusting to around pH 8.5 with 20% aqueous sodium hydroxide, to the mixture was added dropwise the solution A. After stirring at 5° C. for 1 hour, the mixture was extracted with ethyl acetate. The organic layer was washed with water and dried over magnesium sulfate. Removal of the solvent gave a residue, which was chromatographed on silica gel (300 ml) eluting with a mixture of n-hexane and ethyl acetate (5.5-3.7 V/V) to give (2S)-1-(N-allyloxycarbonyl-N-methylaminoacetyl)-2-(2-methyl-3-oxo-1-butenyl)pyrrolidine (3.4 g).

후처리

  1. stirringAfter stirring at ambient temperature for 30 minutes
  2. customthe aqueous layer was separated
  3. washwashed with ethyl acetate and tetrahydrofuran (200 ml)
  4. additionwas added
  5. additionwas added dropwise the solution A
  6. stirringAfter stirring at 5° C. for 1 hour
  7. extractionthe mixture was extracted with ethyl acetate
  8. washThe organic layer was washed with water
  9. dry with materialdried over magnesium sulfate
  10. customRemoval of the solvent
  11. customgave a residue, which
  12. customwas chromatographed on silica gel (300 ml)
  13. washeluting with a mixture of n-hexane and ethyl acetate (5.5-3.7 V/V)

출처 및 근거

ORD 기록
ord-cd0d9073208d4e61ad31d6025f848fd4
출처 데이터셋
uspto-grants-1992_01
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US05081237

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