HRID177377

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID176

Acetic Acid

C2H4O2

HCID813

Potassium cation

K+

HCID887

Methanol

CH4O

HCID961

Hydroxide

HO-

HCID962

Water

H2O

HCID1140

Toluene

C7H8

HCID24425

Chromic(VI) acid

H2CrO4

HCID3912199

未命名化合物

HCID14401080

未命名化合物

PRODUCTS

生成物

HCID14401081

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5d59cd2c552e48d09da9fc0f5690230c
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

[CH3:3][CH:4]([O:11][S:5]([c:6]1[cH:7][cH:8][c:9]([CH3:10])[cH:12][cH:13]1)(=[O:14])=[O:15])[CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH3:21].[CH3:45][OH:46].[CH3:47][C:48](=[O:49])[OH:50].[CH3:52][c:53]1[cH:54][cH:55][cH:56][cH:57][cH:58]1.[Cr:40]([OH:41])([OH:42])(=[O:43])=[O:44].[F:22][c:23]1[cH:24][c:25]([CH:26]=[O:27])[cH:28][cH:29][c:30]1[O:31][CH:32]([CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH3:38])[CH3:39].[K+:2].[OH-:1].[OH2:51]>>[OH:11][C:26]([c:25]1[cH:24][c:23]([F:22])[c:30]([O:31][CH:32]([CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH3:38])[CH3:39])[cH:29][cH:28]1)=[O:27]