HRID1548760

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID961

Hydroxide

HO-

HCID962

Water

H2O

HCID1140

Toluene

C7H8

HCID8028

Tetrahydrofuran

C4H8O

HCID8857

Ethyl acetate

C4H8O2

HCID28486

Lithium ion

Li+

结构：CC(C(=O)[O-])=P(c1ccccc1)(c1ccccc1)c1ccccc1

HCID19995005

未命名化合物

HCID28875322

2-Methyl-6-(trifluoromethyl)pyridine-3-carbaldehyde

C8H6F3NO

PRODUCTS

生成物

HCID68509934

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e5f36c2df37b40ffa02f5a9341459b8f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

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