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Triethylamine → HCID 59767739、化合物

HRID 1445707
ノート
印刷プレビュー

反応式

HRID 1445707 の反応式
[O:1]=[C:2]1[C:11]2[C:6](=[CH:7][CH:8]=[CH:9][CH:10]=2)[C:5]([CH2:12][C:13]2[N:18]=[C:17]([C:19]([OH:21])=O)[CH:16]=[CH:15][CH:14]=2)=[N:4][NH:3]1.C(N(CC)CC)C.C(OC([N:36]1[CH2:41][CH2:40][NH:39][CH2:38][CH2:37]1)=O)(C)(C)C.F[P-](F)(F)(F)(F)F.N1(OC(N(C)C)=[N+](C)C)C2C=CC=CC=2N=N1>CN(C)C=O>[N:36]1([C:19]([C:17]2[N:18]=[C:13]([CH2:12][C:5]3[C:6]4[C:11](=[CH:10][CH:9]=[CH:8][CH:7]=4)[C:2](=[O:1])[NH:3][N:4]=3)[CH:14]=[CH:15][CH:16]=2)=[O:21])[CH2:41][CH2:40][NH:39][CH2:38][CH2:37]1
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 4

HCID 8471TriethylamineHCID 143452tert-Butyl piperazine-1-carboxylateHCID 2733084Methanaminium, N-((1H-benzotriazol-1-yloxy)(dimethylamino)methylene)-N-methyl-, hexafluorophosphate(1-) (1:1)HCID 59767751HCID 59767751、化合物

生成物 1

HCID 59767739HCID 59767739、化合物収率 73%

試薬・触媒・溶媒 1

HCID 6228
Dimethylformamide
溶媒

実験手順

A mixture of 6-(4-oxo-3,4-dihydro-phthalazin-1-ylmethyl)-pyridine-2-carboxylic acid (ivb)(0.3 g, 1.1 mmol), triethylamine (0.3 ml, 2.1 mmol), tert-butyl-1-piperazine carboxylate (0.23 g, 1.3 mmol) and 2-(1H-benzotriazole-1-yl)-1,1,3,3-tetramethyluronium hexafluorophosphate (0.5 g, 1.3 mmol) in dimethylformamide (10 ml) was stirred for 18 hours. The reaction mixture was precipitated on the addition of water (50 ml) and air-dried. The white precipitate was dissolved in ethanol (3 ml) and 12 M hydrochloric acid (6 ml) was added to the solution and the reaction was stirred for 30 minutes. The reaction was then concentrated in vacuo, redissolved in water (10 ml) and washed with dichloromethane (2×10 ml). The aqueous layer was basified with ammonium hydroxide and extracted into dichloromethane (2×10 ml). The combined organic layers was dried with MgSO4, filtered and evaporated to yield the expected product (va) as a pink solid (0.23 g, 73%). m/z [M+1]+ 250 (96% purity)

後処理

  1. customThe reaction mixture was precipitated on the addition of water (50 ml)
  2. customair-dried
  3. dissolutionThe white precipitate was dissolved in ethanol (3 ml)
  4. addition12 M hydrochloric acid (6 ml) was added to the solution
  5. stirringthe reaction was stirred for 30 minutes
  6. concentrationThe reaction was then concentrated in vacuo
  7. dissolutionredissolved in water (10 ml)
  8. washwashed with dichloromethane (2×10 ml)
  9. extractionextracted into dichloromethane (2×10 ml)
  10. dry with materialThe combined organic layers was dried with MgSO4
  11. filtrationfiltered
  12. customevaporated

出典と根拠

ORDレコード
ord-faf8b6a8d7e540178be7bdc5bace9387
出典データセット
uspto-grants-2010_02
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US07666870B2

反応ノート

読み込み中…

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