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Triphenylphosphine → 3-Chloro-4-(propan-2-yloxy)benzoic acid

HRID 423291
ノート
印刷プレビュー

反応式

HRID 423291 の反応式
[CH:1]1[CH:6]=CC(P(C2C=CC=CC=2)C2C=CC=CC=2)=C[CH:2]=1.[Cl:20][C:21]1[CH:22]=[C:23]([CH:28]=[CH:29][C:30]=1[OH:31])[C:24]([O:26]C)=[O:25].CC(OC(/N=N/C(OC(C)C)=O)=O)C.[OH-].[Na+]>C1COCC1.CO.CC(O)C>[Cl:20][C:21]1[CH:22]=[C:23]([CH:28]=[CH:29][C:30]=1[O:31][CH:1]([CH3:6])[CH3:2])[C:24]([OH:26])=[O:25]
参加物反応条件実験手順後処理出典と根拠反応ノート

参加物

8

反応物 4

HCID 11776TriphenylphosphineHCID 14798Sodium HydroxideHCID 77580Methyl 3-chloro-4-hydroxybenzoateHCID 5363146Diisopropyl azodicarboxylate

生成物 1

HCID 225977283-Chloro-4-(propan-2-yloxy)benzoic acid収率 430.8%

試薬・触媒・溶媒 3

HCID 887Methanol
溶媒
HCID 3776Isopropanol溶媒
HCID 8028Tetrahydrofuran溶媒

反応条件

温度
0 °C

実験手順

Propan-2-ol (2.45 ml) and PPh3 (1.18 g) were dissolved in THF (30 ml), cooled to 0° C., treated with methyl 3-chloro-4-hydroxybenzoate (6.00 g) followed by the drop-wise addition of DIAD (9.44 ml) and stirred at RT overnight. The reaction mixture was then evaporated and purified on silica cartridges (4×100 g), eluting with a 0 to 40% mixture of EtOAc in pentane to give the crude product (7.00 g) as a colourless oil. This was dissolved in MeOH (30 ml) and 2 M aqueous NaOH (30 ml) and stirred at RT for a weekend. The reaction mixture was then evaporated and re-dissolved in H2O. This solution was washed with Et2O, acidified to pH=1 and extracted with Et2O. These latter extracts were dried over MgSO4, filtered and evaporated to give the title compound (4.16 g) as a white solid. δH (MeOD, 400 MHz): 1.37 (6H, d), 4.77 (1H, septet), 7.12 (1H, d), 7.90 (1H, d), 7.98 (1H, s). MS (ES): C10H11ClO3 requires 214; found 215 (MH+).

後処理

  1. customThe reaction mixture was then evaporated
  2. custompurified on silica cartridges (4×100 g)
  3. washeluting with a 0 to 40% mixture of EtOAc in pentane
  4. customto give the crude product (7.00 g) as a colourless oil
  5. customThe reaction mixture was then evaporated
  6. dissolutionre-dissolved in H2O
  7. washThis solution was washed with Et2O
  8. extractionextracted with Et2O
  9. dry with materialThese latter extracts were dried over MgSO4
  10. filtrationfiltered
  11. customevaporated

出典と根拠

ORDレコード
ord-5d4f0fa8162f474ab7b4d837b2dc3c1c
出典データセット
uspto-grants-2012_01
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US08101775B2

反応ノート

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