HRID1556311

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID67331

Pyridazine, 3,6-dichloro-

C4H2Cl2N2

HCID28242526

3-Chloro-6-(trifluoromethyl)pyridazine

C5H2ClF3N2

结构：CC(C)C(C)(c1ccc(B2OC(C)(C)C(C)(C)O2)cc1)c1ccc(OCc2ccccn2)cn1

HCID57910791

未命名化合物

结构：CC(C)C(C)(c1ccc(B2OC(C)(C)C(C)(C)O2)cc1)c1ccc(O)cn1

HCID57910802

未命名化合物

PRODUCTS

生成物

结构：CC(C)C(C)(c1ccc(-c2ccc(C(F)(F)F)nn2)cc1)c1ccc(O)cn1

HCID57910803

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-95e889b6de934d2d91ac6f727ca84849
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

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