HRID151757

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7972

4-Methylmorpholine

C5H11NO

HCID8028

Tetrahydrofuran

C4H8O

HCID8058

n-Hexane

C6H14

HCID68515

Benzoyl chloride, 4-bromo-

C7H4BrClO

HCID75351

2,3,5,6-Tetrafluoroanisole

C7H4F4O

HCID10999252

4-Bromo-N-methoxy-N-methylbenzamide

C9H10BrNO2

HCID178418339

Butyllithium

C4H9Li

PRODUCTS

生成物

结构：COc1c(F)c(F)c(C(=O)c2ccc(Br)cc2)c(F)c1F

HCID18434336

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a965ab6372dd41e7acc1828193bfef3c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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