HRID1210368

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

3 次

HCID6569

Methyl ethyl ketone

C4H8O

HCID8173

1-Bromodecane

C10H21Br

HCID19660

Carbonate

CO3-2

HCID30165

Iodide ion

I-

HCID95093

(1,1'-Biphenyl)-4-ol, 4'-bromo-

C12H9BrO

HCID112405

[1,1'-Biphenyl]-4-carbonitrile, 4'-(decyloxy)-

C23H29NO

PRODUCTS

生成物

HCID10668051

4-Bromo-4'-decyloxybiphenyl

C22H29BrO

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d84846e1c9704873a2333534a53c5fff
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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