HRID1556558

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID30165

Iodide ion

I-

HCID166653

Hydride

H-

HCID243666

3-chloropropyl benzoate

C10H11ClO2

结构：CC(C)c1[nH]nc(O[Si](C(C)C)(C(C)C)C(C)C)c1Cc1ccc(I)cc1

HCID68540760

未命名化合物

PRODUCTS

生成物

结构：CC(C)c1c(Cc2ccc(I)cc2)c(O[Si](C(C)C)(C(C)C)C(C)C)nn1CCCOC(=O)c1ccccc1

HCID68539181

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ee2d0480d5864ae8a0182baae2cafd8b
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

[C:30]([c:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1)(=[O:37])[O:38][CH2:39][CH2:40][CH2:41][Cl:42].[CH3:45][N:46]([CH3:47])[CH:48]=[O:49].[H-:28].[I-:44].[I:1][c:2]1[cH:3][cH:4][c:5]([CH2:8][c:9]2[c:10]([O:17][Si:18]([CH:19]([CH3:20])[CH3:21])([CH:22]([CH3:23])[CH3:24])[CH:25]([CH3:26])[CH3:27])[n:11][nH:12][c:13]2[CH:14]([CH3:15])[CH3:16])[cH:6][cH:7]1.[K+:43].[Na+:29].[OH2:50]>>[I:1][c:2]1[cH:3][cH:4][c:5]([CH2:8][c:9]2[c:10]([O:17][Si:18]([CH:19]([CH3:20])[CH3:21])([CH:22]([CH3:23])[CH3:24])[CH:25]([CH3:26])[CH3:27])[n:11][n:12]([CH2:41][CH2:40][CH2:39][O:38][C:30]([c:31]3[cH:32][cH:33][cH:34][cH:35][cH:36]3)=[O:37])[c:13]2[CH:14]([CH3:15])[CH3:16])[cH:6][cH:7]1