HRID199072

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID8471

Triethylamine

C6H15N

HCID31275

1,4-Dioxane

C4H8O2

HCID105144

Palladium(2+)

Pd+2

结构：c1ccc(-c2ccccc2P(C2CCCCC2)C2CCCCC2)cc1

HCID2734216

2-(Dicyclohexylphosphino)biphenyl

C24H31P

HCID2734768

未命名化合物

HCID21886489

未命名化合物

PRODUCTS

生成物

结构：COc1cc(C)c(B2OC(C)(C)C(C)(C)O2)c(N)c1

HCID21886558

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fdf01f5944084e7082c34f2570755f84
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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