HRID318525

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID962

Water

H2O

HCID13651

4-Phenylpyridine

C11H9N

HCID31275

1,4-Dioxane

C4H8O2

HCID20186514

未命名化合物

PRODUCTS

产物

HCID312

Chloride

Cl-

HCID3065531

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-9d8326876fd446c4aff0bb007db86a0d
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应SMILES

[ClH:35].[O:1]1[CH:2]([CH2:3][O:4][c:5]2[cH:6][cH:7][c:8]([C:9](=[O:10])[c:11]3[cH:12][cH:13][c:14]([N+:17](=[O:18])[O-:19])[cH:15][cH:16]3)[cH:20][cH:21]2)[CH2:22]1.[O:36]1[CH2:37][CH2:38][O:39][CH2:40][CH2:41]1.[OH2:42].[c:23]1(-[c:29]2[cH:30][cH:31][n:32][cH:33][cH:34]2)[cH:24][cH:25][cH:26][cH:27][cH:28]1>>[Cl-:35].[OH:1][CH:2]([CH2:3][O:4][c:5]1[cH:6][cH:7][c:8]([C:9](=[O:10])[c:11]2[cH:12][cH:13][c:14]([N+:17](=[O:18])[O-:19])[cH:15][cH:16]2)[cH:20][cH:21]1)[CH2:22][n+:32]1[cH:31][cH:30][c:29](-[c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[cH:34][cH:33]1