HRID110389

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8058

n-Hexane

C6H14

HCID8471

Triethylamine

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

HCID66111

Trimethylsilylacetylene

C5H10Si

HCID57424214

未命名化合物

PRODUCTS

生成物

结构：CC1(C)CC(C)(C)c2cc(Br)cc(C#C[Si](C)(C)C)c2O1

HCID57424216

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a68321b23bf34de3927f5ce7d633dd19
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[Br:1][c:2]1[cH:3][c:4]2[c:9]([c:10]([OH:12])[cH:11]1)[O:8][C:7]([CH3:13])([CH3:14])[CH2:6][C:5]2([CH3:15])[CH3:16].[CH2:17]([N:18]([CH2:19][CH3:20])[CH2:21][CH3:22])[CH3:23].[CH3:24][Si:25]([CH3:26])([CH3:27])[C:28]#[CH:29].[CH3:30][CH2:31][O:32][C:33](=[O:34])[CH3:35].[CH3:36][CH2:37][CH2:38][CH2:39][CH2:40][CH3:41].[Cu:42][I:43].[Pd:44]([Cl:45])[Cl:46].[c:47]1([P:48]([c:49]2[cH:50][cH:51][cH:52][cH:53][cH:54]2)[c:55]2[cH:56][cH:57][cH:58][cH:59][cH:60]2)[cH:61][cH:62][cH:63][cH:64][cH:65]1.[c:66]1([P:67]([c:68]2[cH:69][cH:70][cH:71][cH:72][cH:73]2)[c:74]2[cH:75][cH:76][cH:77][cH:78][cH:79]2)[cH:80][cH:81][cH:82][cH:83][cH:84]1>>[Br:1][c:2]1[cH:3][c:4]2[c:9]([c:10]([C:29]#[C:28][Si:25]([CH3:24])([CH3:26])[CH3:27])[cH:11]1)[O:8][C:7]([CH3:13])([CH3:14])[CH2:6][C:5]2([CH3:15])[CH3:16]