HRID95559

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID679

Dimethyl sulfoxide

C2H6OS

HCID962

Water

H2O

HCID6456

Trityl chloride

C19H15Cl

HCID74828

6-Chlorohexan-1-ol

C6H13ClO

结构：ClCCCCCCOC(c1ccccc1)(c1ccccc1)c1ccccc1

HCID11955063

Benzene, 1,1',1''-[[(6-chlorohexyl)oxy]methylidyne]tris-

C25H27ClO

PRODUCTS

生成物

结构：C#CCCCCCCOC(c1ccccc1)(c1ccccc1)c1ccccc1

HCID20381044

1,1',1''-{[(Oct-7-yn-1-yl)oxy]methanetriyl}tribenzene

C27H28O

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-41e1309760754ba09d4c9d4b86a18975
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[CH3:58][S:59]([CH3:60])=[O:61].[Cl:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][O:8][C:9]([c:10]1[cH:11][cH:12][cH:13][cH:14][cH:15]1)([c:16]1[cH:17][cH:18][cH:19][cH:20][cH:21]1)[c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1.[Cl:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][OH:35].[ClH:56].[OH2:57].[c:36]1([C:37]([Cl:38])([c:39]2[cH:40][cH:41][cH:42][cH:43][cH:44]2)[c:45]2[cH:46][cH:47][cH:48][cH:49][cH:50]2)[cH:51][cH:52][cH:53][cH:54][cH:55]1>>[CH2:2]([CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][O:8][C:9]([c:10]1[cH:11][cH:12][cH:13][cH:14][cH:15]1)([c:16]1[cH:17][cH:18][cH:19][cH:20][cH:21]1)[c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1)[C:29]#[CH:30]