查数据/反应详情

HRID281104

反应详情

EQUATION

反应方程式

HRID 281104 的结构方程式

REACTANTS

反应物

2

结构：OCCCl

2-Chloroethanol

C2H5ClO

结构：O=C(Cl)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

Pentadecafluorooctanoyl chloride

C8ClF15O

PRODUCTS

生成物

1

结构：O=C(OCCCl)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-cac970e8afc54288b04d823e1bb3bef2
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

[F:1][C:2]([C:3](=[O:4])[Cl:5])([C:6]([C:7]([C:8]([C:9]([C:10]([C:11]([F:12])([F:13])[F:14])([F:15])[F:16])([F:17])[F:18])([F:19])[F:20])([F:21])[F:22])([F:23])[F:24])[F:25].[OH:26][CH2:27][CH2:28][Cl:29]>>[F:1][C:2]([C:3](=[O:4])[O:26][CH2:27][CH2:28][Cl:29])([C:6]([C:7]([C:8]([C:9]([C:10]([C:11]([F:12])([F:13])[F:14])([F:15])[F:16])([F:17])[F:18])([F:19])[F:20])([F:21])[F:22])([F:23])[F:24])[F:25]

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