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Diisopropylamine → N-(4-ethynyl-2-nitro-phenyl)-N,N',N'-trimethyl-propane-1,3-diamine

HRID 446240
ノート
印刷プレビュー

反応式

HRID 446240 の反応式
Br[C:2]1[CH:7]=[CH:6][C:5]([N:8]([CH3:15])[CH2:9][CH2:10][CH2:11][N:12]([CH3:14])[CH3:13])=[C:4]([N+:16]([O-:18])=[O:17])[CH:3]=1.P(C(C)(C)C)(C(C)(C)C)[C:20](C)(C)[CH3:21].[H+].[B-](F)(F)(F)F.N(C(C)C)C(C)C.C[Si](C#C)(C)C.C([O-])([O-])=O.[K+].[K+]>CO.C1C=CC(C#N)=CC=1.C1C=CC(C#N)=CC=1.Cl[Pd]Cl.[Cu]I.O1CCOCC1>[C:20]([C:2]1[CH:7]=[CH:6][C:5]([N:8]([CH3:15])[CH2:9][CH2:10][CH2:11][N:12]([CH3:14])[CH3:13])=[C:4]([N+:16]([O-:18])=[O:17])[CH:3]=1)#[CH:21]
参加物実験手順後処理出典と根拠反応ノート

参加物

11

反応物 6

HCID 7912DiisopropylamineHCID 11430Potassium CarbonateHCID 28118Tetrafluoroboric acidHCID 66111TrimethylsilylacetyleneHCID 83681Tris(1,1-dimethylethyl)phosphineHCID 16109013HCID 16109013、化合物

生成物 1

HCID 86602587
N-(4-ethynyl-2-nitro-phenyl)-N,N',N'-trimethyl-propane-1,3-diamine

試薬・触媒・溶媒 4

HCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)触媒HCID 498840Bis(benzonitrile)palladium chloride触媒HCID 887Methanol溶媒HCID 312751,4-Dioxane溶媒

実験手順

To N-(4-bromo-2-nitro-phenyl)-N,N′,N′-trimethyl-propane-1,3-diamine (940 mg, 2.97 mmol), Pd(PhCN)2Cl2 (34 mg, 0.09 mmol), CuI (11 mg, 0.06 mmol) and dioxane (4 mL) was added P(tBu)3.HBF4 (53 mg, 0.18 mmol), iPr2NH (0.50 mL, 3.6 mmol) and (trimethylsilyl)acetylene (0.49 mL, 3.6 mmol). The mixture was stirred for 3.5 h at RT, diluted with MeOH and stirred at RT with excess saturated aqueous K2CO3 for 2 h. The mixture was filtered through a pad of activated charcoal and concentrated to yield N-(4-ethynyl-2-nitro-phenyl)-N,N′, N′-trimethyl-propane-1,3-diamine. MS m/z=262 [M+1]+. Calc'd for C14H19N3O2: 261.33.

後処理

  1. filtrationThe mixture was filtered through a pad of activated charcoal
  2. concentrationconcentrated

出典と根拠

ORDレコード
ord-4a79f17e14d649e696f973ba160f5851
出典データセット
uspto-grants-2013_07
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US08476434B2

反応ノート

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