HRID107350

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID6342

Acetonitrile

C2H3N

HCID19660

Carbonate

CO3-2

HCID57443272

3-Methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol

C13H19BO3

HCID66906092

未命名化合物

PRODUCTS

生成物

结构：Cc1cc(OCc2c(-c3ccccc3OC(F)(F)F)noc2C2CC2)ccc1B1OC(C)(C)C(C)(C)O1

HCID67272361

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-82b9dec0af14469fa83a7c0d7e346a94
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

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