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Sodium methanethiolate → (2-Amino-6-methylsulfanyl-3-nitro-pyridin-4-yl)-benzyl-carbamic acid ethyl ester

HRID 639666
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HRID 639666 반응식
[CH3:1][S-:2].[Na+].[CH2:4]([O:6][C:7](=[O:27])[N:8]([C:16]1[CH:21]=[C:20](Cl)[N:19]=[C:18]([NH2:23])[C:17]=1[N+:24]([O-:26])=[O:25])[CH2:9][C:10]1[CH:15]=[CH:14][CH:13]=[CH:12][CH:11]=1)[CH3:5]>CO.C1COCC1.CO>[CH2:4]([O:6][C:7](=[O:27])[N:8]([C:16]1[CH:21]=[C:20]([S:2][CH3:1])[N:19]=[C:18]([NH2:23])[C:17]=1[N+:24]([O-:26])=[O:25])[CH2:9][C:10]1[CH:15]=[CH:14][CH:13]=[CH:12][CH:11]=1)[CH3:5]
참가 물질실험 절차후처리출처 및 근거반응 노트

참가 물질

5

반응물 2

HCID 4378561Sodium methanethiolateHCID 57856589(2-Amino-6-chloro-3-nitro-pyridin-4-yl)-benzyl-carbamic acid ethyl ester

생성물 1

HCID 67455771(2-Amino-6-methylsulfanyl-3-nitro-pyridin-4-yl)-benzyl-carbamic acid ethyl ester수율 95.8%

시약·촉매·용매 2

HCID 887Methanol용매HCID 21899815MeOH tetrahydrofuran용매

실험 절차

Sodium methanethiolate (180 mg) was added portion-wise to a stirred suspension of (2-amino-6-chloro-3-nitro-pyridin-4-yl)-benzyl-carbamic acid ethyl ester (300 mg) in methanol:THF (3:1, 4 ml). The mixture was sealed in a ReactiVial then left to stir at room temperature for 2 hours. The reaction mixture was diluted with methanol then pre-absorbed directly onto silica gel. The crude was columned on Isco Companion on a silica column (12 g, Redisep), eluting with EtOAc:heptane, increasing the gradient linearly from 30:70 to 50:50 over 6 column volumes. The desired fractions were combined and evaporated to provide the title compound (297 mg) as a yellow gum.

후처리

  1. customThe mixture was sealed in a ReactiVial
  2. waitthen left
  3. customthen pre-absorbed directly onto silica gel
  4. washeluting with EtOAc
  5. temperatureheptane, increasing the gradient linearly from 30:70 to 50:50 over 6 column volumes
  6. customevaporated

출처 및 근거

ORD 기록
ord-fd0ec1c99d2b41608eadd7332b78afef
출처 데이터셋
uspto-grants-2010_04
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US07691877B2

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