HRID184923

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID176

Acetic Acid

C2H4O2

2 次

HCID813

Potassium cation

K+

HCID962

Water

H2O

HCID1118

Sulfuric acid

H2O4S

HCID1140

Toluene

C7H8

HCID7020

Xanthone

C13H8O2

HCID7918

Acetic anhydride

C4H6O3

HCID11575

Benzene, iodo-

C6H5I

HCID26255

Tetrafluoroborate

BF4-

PRODUCTS

生成物

HCID26255

Tetrafluoroborate

BF4-

HCID23034925

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-01d9bfa37da547a39918705e67249e80
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[B-:43]([F:44])([F:45])([F:46])[F:47].[C:23]([OH:24])(=[O:25])[CH3:26].[C:27]([OH:28])(=[O:29])[CH3:30].[CH3:1][C:2]([O:3][C:4](=[O:5])[CH3:6])=[O:7].[CH3:50][c:51]1[cH:52][cH:53][cH:54][cH:55][cH:56]1.[I:31][c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1.[K+:48].[OH2:49].[S:38](=[O:39])(=[O:40])([OH:41])[OH:42].[cH:8]1[cH:9][cH:10][cH:11][c:12]2[o:13][c:14]3[cH:15][cH:16][cH:17][cH:18][c:19]3[c:20](=[O:22])[c:21]12>>[B-:43]([F:44])([F:45])([F:46])[F:47].[cH:8]1[c:9]([I+:31][c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)[cH:10][cH:11][c:12]2[o:13][c:14]3[cH:15][cH:16][cH:17][cH:18][c:19]3[c:20](=[O:22])[c:21]12