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Trifluoroacetic acid → (11beta,17beta)-17-(Ethylthio)-9-fluoro-11-hydroxyandrosta-1,4-dien-3-one

HRID 371060
ノート
印刷プレビュー

反応式

HRID 371060 の反応式
[CH2:1]([S:3][C:4]1[C@:5]2([CH2:22][C@H:21]([OH:23])[C@@:20]3([F:24])[C@@H:10]([CH2:11][CH2:12][C:13]4[C@:18]3([CH3:19])[CH:17]=[CH:16][C:15](=[O:25])[CH:14]=4)[C@@H:7]2[CH2:8][CH:9]=1)[CH3:6])[CH3:2].FC(F)(F)C(O)=O.C([SiH](CC)CC)C>ClCCl.C(Cl)(Cl)Cl.CCCCCC>[CH2:1]([S:3][C@H:4]1[CH2:9][CH2:8][C@H:7]2[C@H:10]3[C@:20]([F:24])([C@@H:21]([OH:23])[CH2:22][C@:5]12[CH3:6])[C@:18]1([CH3:19])[C:13](=[CH:14][C:15](=[O:25])[CH:16]=[CH:17]1)[CH2:12][CH2:11]3)[CH3:2]
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 6422Trifluoroacetic acid2 回HCID 12052Triethylsilane2 回HCID 1291771217-Ethylthio-9-fluoro-11beta-hydroxyandrosta-1,4,16-triene-3-one

生成物 1

HCID 70401069(11beta,17beta)-17-(Ethylthio)-9-fluoro-11-hydroxyandrosta-1,4-dien-3-one収率 85.9%

試薬・触媒・溶媒 2

HCID 6344Dichloromethane
溶媒
2 回
HCID 21585165Chloroform hexane溶媒

実験手順

To a homogeneous solution of 600 mg (1.66 mmole) of 17-(ethylthio)-9-fluoro-11β-hydroxyandrosta-1,4,16-trien-3-one in a mixture of dry dichloromethane (60 ml) and trifluoroacetic acid (207 mg) was added triethylsilane (230 mg) and the mixture was stirred at room temperature under a nitrogen atmosphere for 2.5 hours. Since the tlc of an aliquot showed incomplete reaction, more trifluoroacetic acid (207 mg) and triethylsilane (230 mg) were added. After 1.5 hours the starting material had disappeared by tlc. The resulting solution was diluted with dichloromethane, washed with saturated sodium bicarbonate solution and water, dried (anhydrous sodium sulfate) and evaporated in vacuo to give a solid. This was redissolved in 1:4 hexane chloroform and chromatographed on a 30 g silica gel column. Elution with 1:4 hexane-chloroform, chloroform and 5:95 ethyl acetate-chloroform gave 520 mg of a tlc-homogeneous title compound. Crystallization from acetone-hexane gave 410 mg of an analytical specimen, melting point 223°-225° C., with consistent spectral data.

後処理

  1. additionwere added
  2. waitAfter 1.5 hours the starting material had disappeared by tlc
  3. washwashed with saturated sodium bicarbonate solution and water
  4. dry with materialdried (anhydrous sodium sulfate)
  5. customevaporated in vacuo
  6. customto give a solid
  7. customchromatographed on a 30 g silica gel column
  8. washElution with 1:4 hexane-chloroform, chloroform and 5:95 ethyl acetate-chloroform

出典と根拠

ORDレコード
ord-47aa9269b1f14dc58a4ad14220c8a794
出典データセット
uspto-grants-1985_07
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US04529548

反応ノート

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