HRID679010

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID259

Bromide

Br-

HCID312

Chloride

Cl-

HCID923

Sodium ion

Na+

HCID1140

Toluene

C7H8

HCID7732

4-Methoxybenzenamine

C7H9NO

HCID7805

4-Bromotoluene

C7H7Br

HCID4574913

未命名化合物

结构：CC(=C(c1ccccc1)c1ccccc1)P(C1CCCCC1)C1CCCCC1

HCID12010824

Cy-vBRIDP

C27H35P

PRODUCTS

生成物

HCID11435828

4-Methoxy-N-(4-methylphenyl)aniline

C14H15NO

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-bdc5c6cd3fff4f569ff796acb0b533e3
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[Br-:9].[CH3:10][O:11][c:12]1[cH:13][cH:14][c:15]([NH2:18])[cH:16][cH:17]1.[CH3:19][C:20]([CH3:21])([O-:22])[CH3:23].[CH3:55][c:56]1[cH:57][cH:58][cH:59][cH:60][cH:61]1.[Cl-:53].[NH4+:54].[Na+:24].[c:1]1([CH3:8])[cH:2][cH:3][c:4]([Br:7])[cH:5][cH:6]1.[c:25]1([C:26]([c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)=[C:33]([P:34]([CH:35]2[CH2:36][CH2:37][CH2:38][CH2:39][CH2:40]2)[CH:41]2[CH2:42][CH2:43][CH2:44][CH2:45][CH2:46]2)[CH3:47])[cH:48][cH:49][cH:50][cH:51][cH:52]1>>[c:1]1([CH3:8])[cH:2][cH:3][c:4]([NH:18][c:15]2[cH:14][cH:13][c:12]([O:11][CH3:10])[cH:17][cH:16]2)[cH:5][cH:6]1