HRID157282

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7912

Diisopropylamine

C6H15N

HCID8857

Ethyl acetate

C4H8O2

HCID11776

Triphenylphosphine

C18H15P

2 次

HCID24290

未命名化合物

HCID24350

Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)

CuI

HCID17980527

未命名化合物

HCID86601564

未命名化合物

PRODUCTS

生成物

HCID68881217

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-200b5b0594f443b49b3f47a731f260a8
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[CH3:13][O:14][CH:15]([CH2:16][C:17]#[CH:18])[CH3:19].[CH3:27][CH2:28][O:29][C:30](=[O:31])[CH3:32].[CH:20]([NH:21][CH:22]([CH3:23])[CH3:24])([CH3:25])[CH3:26].[Cl:1][c:2]1[c:3]([NH2:12])[c:4]2[c:5]([c:9]([I:11])[cH:10]1)[O:6][CH2:7][O:8]2.[Cu:74][I:75].[Pd:33]([Cl:34])[Cl:35].[c:36]1([P:37]([c:38]2[cH:39][cH:40][cH:41][cH:42][cH:43]2)[c:44]2[cH:45][cH:46][cH:47][cH:48][cH:49]2)[cH:50][cH:51][cH:52][cH:53][cH:54]1.[c:55]1([P:56]([c:57]2[cH:58][cH:59][cH:60][cH:61][cH:62]2)[c:63]2[cH:64][cH:65][cH:66][cH:67][cH:68]2)[cH:69][cH:70][cH:71][cH:72][cH:73]1>>[Cl:1][c:2]1[c:3]([NH2:12])[c:4]2[c:5]([c:9]([C:18]#[C:17][CH2:16][CH:15]([O:14][CH3:13])[CH3:19])[cH:10]1)[O:6][CH2:7][O:8]2