HRID156023

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID28486

Lithium ion

Li+

HCID5062348

未命名化合物

结构：Brc1ccccc1-c1cn(C(c2ccccc2)(c2ccccc2)c2ccccc2)cn1

HCID22185143

未命名化合物

结构：CCc1cc(C=O)c(F)c(O[Si](C)(C)C(C)(C)C)c1

HCID59838072

3-{[tert-Butyl(dimethyl)silyl]oxy}-5-ethyl-2-fluorobenzaldehyde

C15H23FO2Si

PRODUCTS

生成物

结构：CCc1cc(O[Si](C)(C)C(C)(C)C)c(F)c(C(O)c2nc(-c3ccccc3Br)cn2C(c2ccccc2)(c2ccccc2)c2ccccc2)c1

HCID68815662

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5ea7159c2cac4a0d90fe83ecb60ffbaa
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][c:2]1[c:3](-[c:8]2[n:9][cH:10][n:11]([C:13]([c:14]3[cH:15][cH:16][cH:17][cH:18][cH:19]3)([c:20]3[cH:21][cH:22][cH:23][cH:24][cH:25]3)[c:26]3[cH:27][cH:28][cH:29][cH:30][cH:31]3)[cH:12]2)[cH:4][cH:5][cH:6][cH:7]1.[C:40]([CH3:41])([CH3:42])([CH3:43])[Si:44]([O:45][c:46]1[c:47]([F:56])[c:48]([CH:49]=[O:50])[cH:51][c:52]([CH2:54][CH3:55])[cH:53]1)([CH3:57])[CH3:58].[CH2:59]1[O:60][CH2:61][CH2:62][CH2:63]1.[CH:32]([N-:33][CH:34]([CH3:35])[CH3:36])([CH3:37])[CH3:38].[Li+:39]>>[Br:1][c:2]1[c:3](-[c:8]2[n:9][c:10]([CH:49]([c:48]3[c:47]([F:56])[c:46]([O:45][Si:44]([C:40]([CH3:41])([CH3:42])[CH3:43])([CH3:57])[CH3:58])[cH:53][c:52]([CH2:54][CH3:55])[cH:51]3)[OH:50])[n:11]([C:13]([c:14]3[cH:15][cH:16][cH:17][cH:18][cH:19]3)([c:20]3[cH:21][cH:22][cH:23][cH:24][cH:25]3)[c:26]3[cH:27][cH:28][cH:29][cH:30][cH:31]3)[cH:12]2)[cH:4][cH:5][cH:6][cH:7]1