HRID206456

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID603866

4'-Bromo-2,2,2-trifluoroacetophenone

C8H4BrF3O

结构：CC(C)(C)[Si](C)(C)OC(CCCCCCc1ccccc1)c1ncc(-c2ccc(C(=O)C(F)(F)F)cc2)o1

HCID16110616

未命名化合物

结构：CCC[CH2][Sn]([CH2]CCC)([CH2]CCC)[c]1cnc(C(CCCCCCc2ccccc2)O[Si](C)(C)C(C)(C)C)o1

HCID67046048

未命名化合物

PRODUCTS

生成物

结构：O=C(CCCCCCc1ccccc1)c1ncc(-c2ccc(C(=O)C(F)(F)F)cc2)o1

HCID16110648

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-61ecf01e20f64ae0a3ea1d8498f48694
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[Br:78][c:79]1[cH:80][cH:81][c:82]([C:83](=[O:84])[C:85]([F:86])([F:87])[F:88])[cH:89][cH:90]1.[C:1]([Si:2]([CH3:3])([CH3:4])[O:6][CH:7]([CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)[c:20]1[o:21][c:22](-[c:25]2[cH:26][cH:27][c:28]([C:31]([C:32]([F:33])([F:34])[F:35])=[O:36])[cH:29][cH:30]2)[cH:23][n:24]1)([CH3:5])([CH3:37])[CH3:38].[C:39]([Si:40]([CH3:41])([CH3:42])[O:43][CH:44]([c:45]1[o:46][c:47]([Sn:48]([CH2:49][CH2:50][CH2:51][CH3:52])([CH2:53][CH2:54][CH2:55][CH3:56])[CH2:57][CH2:58][CH2:59][CH3:60])[cH:61][n:62]1)[CH2:63][CH2:64][CH2:65][CH2:66][CH2:67][CH2:68][c:69]1[cH:70][cH:71][cH:72][cH:73][cH:74]1)([CH3:75])([CH3:76])[CH3:77]>>[O:6]=[C:7]([CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)[c:20]1[o:21][c:22](-[c:25]2[cH:26][cH:27][c:28]([C:31]([C:32]([F:33])([F:34])[F:35])=[O:36])[cH:29][cH:30]2)[cH:23][n:24]1