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Sodium Hydroxide → 6-Ethynyl-1,1,4,4-tetramethyl-7-propoxy-1,2,3,4-tetrahydronaphthalene

HRID 1265244
ノート
印刷プレビュー

反応式

HRID 1265244 の反応式
P(Cl)(Cl)(Cl)=O.[CH2:6]([O:9][C:10]1[C:11]([C:24](=O)[CH3:25])=[CH:12][C:13]2[C:14]([CH3:23])([CH3:22])[CH2:15][CH2:16][C:17]([CH3:21])([CH3:20])[C:18]=2[CH:19]=1)[CH2:7][CH3:8].C([O-])(O)=O.[Na+].[OH-].[Na+]>O1CCOCC1.O.[Cl-].[Na+].O.O.O1CCOCC1.CN(C=O)C>[C:24]([C:11]1[CH:12]=[C:13]2[C:18](=[CH:19][C:10]=1[O:9][CH2:6][CH2:7][CH3:8])[C:17]([CH3:21])([CH3:20])[CH2:16][CH2:15][C:14]2([CH3:22])[CH3:23])#[CH: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

10

反応物 4

HCID 14798Sodium HydroxideHCID 24813Phosphorus oxychlorideHCID 516892Sodium BicarbonateHCID 101494431-(3-Propoxy-5,6,7,8-tetrahydro-5,5,8,8-tetramethylnaphthalen-2-yl)ethanone

生成物 1

HCID 106596866-Ethynyl-1,1,4,4-tetramethyl-7-propoxy-1,2,3,4-tetrahydronaphthalene収率 39%

試薬・触媒・溶媒 5

HCID 962
Water
溶媒
HCID 6228Dimethylformamide溶媒
HCID 312751,4-Dioxane溶媒
HCID 218864351,4-Dioxane--water (1/1)溶媒
HCID 57417360Sodium chloride; water溶媒

反応条件

温度
60 °C

実験手順

Phosphorous oxychloride (0.234 g, 0.142 mL, 1.52 mmol) was added dropwise to DMF (4 mL) at room temperature under a nitrogen atmosphere. The solution was stirred for 30 min. The 1-(3-propoxy-5,6,7,8-tetrahydro-5,5,8,8-tetramethylnaphthalen-2-yl)ethanone, (prepared as described in Example 21, 0.110 g, 0.381 mmol) was added quickly (in one portion) to the orange solution and the reaction solution was heated to 60° C. and stirred for 12 h. The dark brown solution was poured into ice water and the aqueous layer was adjusted to pH 7 with solid NaHCO3. EtOAc extraction afforded the crude product, the chloro enal, 0.128 g, as an orange/brown oil. To a 80° C. solution of NaOH (0.061 g, 1.52 mmol) in dioxane: H2O (3:2; 20 mL) was added the crude chloro enal in a dioxane:water solution (3:2; 5 mL) in one portion and the yellow reaction solution was stirred at 80° C. for 2 h. The resulting orange reaction solution was cooled to room temperature and poured into brine and extracted with EtOAc. The organic solution was dried (MgSO4), filtered, and concentrated to afford an orange oil which was purified by radial chromatography (10:1=Hex:EtOAc) to give the product 6-ethynyl-1,1,4,4-tetramethyl-7-propoxy-1,2,3,4-tetrahydronapthalene 0.040 g (39%) as a yellow oil: 1H-NMR (400 MHz, CDCl3) δ 7.38 (s, 1H, Ar-H), 6.76 (s, 1Hz, Ar-H), 3.98 (t, J=6.6 Hz, 2H, OCH2), 3.19 (s, 1H, CH), 1.83 (m, 2Hz, CH2), 1.66 (m, 2H, 2CH2), 1.26 (s, 6H, 2CH3), 1.24 (s, 6H, 2CH3), 0.93 (t, J=7.4 Hz, 3H, CH3).

後処理

  1. additionwas added quickly (in one portion) to the orange solution
  2. stirringstirred for 12 h
  3. extractionEtOAc extraction
  4. customafforded the crude product
  5. temperatureThe resulting orange reaction solution was cooled to room temperature
  6. extractionextracted with EtOAc
  7. dry with materialThe organic solution was dried (MgSO4)
  8. filtrationfiltered
  9. concentrationconcentrated
  10. customto afford an orange oil which
  11. customwas purified by radial chromatography (10:1=Hex:EtOAc)

出典と根拠

ORDレコード
ord-45f8780c778b44359dc892c2341818f9
出典データセット
uspto-grants-2003_04
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US06545049B1

反応ノート

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