HRID154462

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID241

Benzene

C6H6

HCID263

1-Butanol

C4H10O

HCID6101

4-Methylbenzenesulfonic acid

C7H8O3S

HCID75828

2-Bromo-1-(2,4-dichlorophenyl)ethan-1-one

C8H5BrCl2O

HCID20332658

3-[(4-Chloronaphthalen-1-yl)oxy]propane-1,2-diol

C13H13ClO3

PRODUCTS

产物

HCID20332695

2-(Bromomethyl)-4-(4-chloro-1-naphthalenyloxymethyl)-2-(2,4-dichlorophenyl)-1,3-dioxolane

C21H16BrCl3O3

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-ff7c4b924eae45188637b81d850fb847
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

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