HRID156851

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID6228

N,N-Dimethylformamide

C3H7NO

结构：[O]=[Cr](=[O])([O-])[O][Cr](=[O])(=[O])[O-]

HCID24503

Dichromate

Cr2O7-2

HCID4989215

Pyridinium

C5H6N+

2 次

HCID20488018

7-(4-Octylphenyl)hept-5-yn-1-ol

C21H32O

PRODUCTS

生成物

HCID20488022

7-(4-Octylphenyl)hept-5-ynoic acid

C21H30O2

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d0a058d3916d4359bd3e23220a821944
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

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