HRID2151954

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID259

Bromide

Br-

HCID312

Chloride

Cl-

2 次

HCID8028

Tetrahydrofuran

C4H8O

HCID15413

Methyl tert-butyl ether

C5H12O

HCID32051

Zinc (II) cation

Zn+2

HCID54295990

未命名化合物

HCID178507001

未命名化合物

PRODUCTS

生成物

结构：CC(C)(c1ccccc1)n1nnc(-c2ccccc2-c2ccc(C3OCCCO3)cc2)n1

HCID11339318

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2d51e4b179ed4a78ae0d32d47b4ce778
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[Br-:27].[CH3:41][O:42][C:43]([CH3:44])([CH3:45])[CH3:46].[Cl-:47].[Cl-:49].[Cl:6][c:7]1[c:8](-[c:13]2[n:14][n:15][n:16]([C:18]([CH3:19])([c:20]3[cH:21][cH:22][cH:23][cH:24][cH:25]3)[CH3:26])[n:17]2)[cH:9][cH:10][cH:11][cH:12]1.[O:1]1[CH2:2][CH2:3][CH2:4][CH2:5]1.[O:28]1[CH:29]([c:34]2[cH:35][cH:36][c:37]([Mg+:40])[cH:38][cH:39]2)[O:30][CH2:31][CH2:32][CH2:33]1.[Zn+2:48]>>[c:7]1(-[c:37]2[cH:36][cH:35][c:34]([CH:29]3[O:28][CH2:33][CH2:32][CH2:31][O:30]3)[cH:39][cH:38]2)[c:8](-[c:13]2[n:14][n:15][n:16]([C:18]([CH3:19])([c:20]3[cH:21][cH:22][cH:23][cH:24][cH:25]3)[CH3:26])[n:17]2)[cH:9][cH:10][cH:11][cH:12]1