HRID94888

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID312

Chloride

Cl-

HCID7498

alpha-Bromotoluene

C7H7Br

HCID7912

Diisopropylamine

C6H15N

HCID8028

Tetrahydrofuran

C4H8O

HCID12679

Hexamethylphosphoramide

C6H18N3OP

HCID54075676

未命名化合物

HCID178418339

Butyllithium

C4H9Li

PRODUCTS

生成物

HCID54120089

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-70ce72a136eb491cb7f930c41519b75c
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:28][CH2:29][c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1.[CH2:1]([Li:2])[CH2:3][CH2:4][CH3:5].[CH3:13][O:14][C:15]([C:16]([CH2:17][CH2:18][C:19](=[O:20])[O:21][CH3:22])=[O:23])([O:24][CH3:25])[O:26][CH3:27].[CH3:43][N:44]([P:45]([N:46]([CH3:47])[CH3:48])([N:49]([CH3:50])[CH3:51])=[O:52])[CH3:53].[CH:6]([NH:7][CH:8]([CH3:9])[CH3:10])([CH3:11])[CH3:12].[Cl-:36].[NH4+:37].[O:38]1[CH2:39][CH2:40][CH2:41][CH2:42]1>>[CH3:13][O:14][C:15]([C:16]([CH2:17][CH:18]([C:19](=[O:20])[O:21][CH3:22])[CH2:29][c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1)=[O:23])([O:24][CH3:25])[O:26][CH3:27]