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Chloroform → 3-chloromethyl-5-methylthio-4-propyl-4H-1,2,4-triazole hydrochloride

HRID 856654
ノート
印刷プレビュー

反応式

HRID 856654 の反応式
OC[C:3]1[N:7]([CH2:8][CH2:9][CH3:10])[C:6]([S:11][CH3:12])=[N:5][N:4]=1.[CH:13]([Cl:16])(Cl)[Cl:14]>S(Cl)(Cl)=O>[ClH:14].[Cl:16][CH2:13][C:3]1[N:7]([CH2:8][CH2:9][CH3:10])[C:6]([S:11][CH3:12])=[N:5][N:4]=1
参加物実験手順後処理出典と根拠反応ノート

参加物

4

反応物 2

HCID 6212ChloroformHCID 229388793-hydroxymethyl-5-methylthio-4-propyl-4H-1,2,4-triazole

生成物 1

HCID 229388683-chloromethyl-5-methylthio-4-propyl-4H-1,2,4-triazole hydrochloride

試薬・触媒・溶媒 1

HCID 24386Thionyl Chloride溶媒

実験手順

A solution of 3-hydroxymethyl-4-propyl-5-mercapto-4H-1,2,4-triazole (2.0 g), iodo methane (1.1 ml) and triethylamine (2.5 ml) in ethanol (20 ml) was stirred for 2 days at 50° C. The reaction mixture was concentrated under reduced pressure, and the obtained residue was purified by column chromatography (ethanol:ethyl acetate 1:5→1:4), to give 3-hydroxymethyl-5-methylthio-4-propyl-4H-1,2,4-triazole (2.13 g) as pale yellow oil. To a solution of 3-hydroxymethyl-5-methylthio-4-propyl-4H-1,2,4-triazole (2.13 g) in chloroform (6 ml), thionyl chloride (16 ml) was slowly added at 0° C. The mixture was heated to reflux for 2 hours, and concentrated under reduced pressure. To the residue were added small amount of ethanol and ethyl acetate, and the precipitated crystals were collected by filtration. The crystals were washed with ethyl acetate and diethylether, to give 3-chloromethyl-5-methylthio-4-propyl-4H-1,2,4-triazole hydrochloride (1.06 g) as colorless crystals.

後処理

  1. temperatureThe mixture was heated
  2. temperatureto reflux for 2 hours
  3. concentrationconcentrated under reduced pressure
  4. additionTo the residue were added small amount of ethanol and ethyl acetate
  5. filtrationthe precipitated crystals were collected by filtration
  6. washThe crystals were washed with ethyl acetate and diethylether

出典と根拠

ORDレコード
ord-3b2988be36ca491285302671c6c6480e
出典データセット
uspto-grants-2007_08
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US07262185B2

反応ノート

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