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Water → (2E,4S)-4-({[(1,1-dimethylethyl)oxy]carbonyl}amino)-2-hexenoic acid

HRID 78733
ノート
印刷プレビュー

反応式

HRID 78733 の反応式
[Li+].[OH-].[CH3:3][C:4]([O:7][C:8]([NH:10][C@@H:11]([CH2:18][CH3:19])/[CH:12]=[CH:13]/[C:14]([O:16]C)=[O:15])=[O:9])([CH3:6])[CH3:5].O>C1COCC1.CO>[CH3:6][C:4]([O:7][C:8]([NH:10][C@@H:11]([CH2:18][CH3:19])/[CH:12]=[CH:13]/[C:14]([OH:16])=[O:15])=[O:9])([CH3:3])[CH3:5]
参加物実験手順後処理出典と根拠反応ノート

参加物

6

反応物 3

HCID 962WaterHCID 3939Lithium HydroxideHCID 86666383HCID 86666383、化合物

生成物 1

HCID 86704312(2E,4S)-4-({[(1,1-dimethylethyl)oxy]carbonyl}amino)-2-hexenoic acid収率 107.7%

試薬・触媒・溶媒 2

HCID 887Methanol溶媒HCID 8028Tetrahydrofuran溶媒

実験手順

LiOH (2.95 g, 123 mmol) was added to a solution of methyl (2E,4S)-4-({[(1,1-dimethylethyl)oxy]carbonyl}amino)-2-hexenoate (6 g, 24.66 mmol) in THF (50 mL), MeOH (10.00 mL), and water (50.0 mL). The reaction was stirred overnight at RT. After 18.5 h, the reaction mixture was concentrated under reduced pressure to remove the THF and MeOH. Water (40 mL) was added, and aqueous mixture was adjusted to pH=3 with 6 M aq. HCl, as measured by pH paper. EtOAc (80 mL) was added, the layers were separated, and the aqueous layer was extracted with EtOAc (2×40 mL). The combined organic layers were dried over Na2SO4, concentrated under reduced pressure, and dried under high vacuum, giving 6.09 g of the title compound. LC-MS m/z 230 (M+H)+, 0.77 min (ret time).

後処理

  1. waitAfter 18.5 h
  2. concentrationthe reaction mixture was concentrated under reduced pressure
  3. customto remove the THF and MeOH
  4. additionWater (40 mL) was added
  5. additionEtOAc (80 mL) was added
  6. customthe layers were separated
  7. extractionthe aqueous layer was extracted with EtOAc (2×40 mL)
  8. dry with materialThe combined organic layers were dried over Na2SO4
  9. concentrationconcentrated under reduced pressure
  10. customdried under high vacuum

出典と根拠

ORDレコード
ord-2f8c9416e27740be98b0442139d0d73c
出典データセット
uspto-grants-2014_09
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US08841463B2

反応ノート

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