HRID308038

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID8028

Tetrahydrofuran

C4H8O

HCID19660

Carbonate

CO3-2

HCID11207603

未命名化合物

HCID11637419

3-(3,5-difluoro-pyridin-2-yl)-4-fluorophenylboronic acid

C11H7BF3NO2

结构：c1ccc([PH](c2ccccc2)(c2ccccc2)[Pd]([PH](c2ccccc2)(c2ccccc2)c2ccccc2)([PH](c2ccccc2)(c2ccccc2)c2ccccc2)[PH](c2ccccc2)(c2ccccc2)c2ccccc2)cc1

HCID178420554

未命名化合物

PRODUCTS

生成物

结构：CC(C)(O)c1cnn2c(-c3ccc(F)c(-c4ncc(F)cc4F)c3)cnc2n1

HCID10271398

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c9d72cbb09be4d4bbc52ad63471d58ff
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[Br:19][c:20]1[cH:21][n:22][c:23]2[n:24]1[n:25][cH:26][c:27]([C:29]([CH3:30])([CH3:31])[OH:32])[n:28]2.[F:1][c:2]1[c:3](-[c:11]2[n:12][cH:13][c:14]([F:18])[cH:15][c:16]2[F:17])[cH:4][c:5]([B:8]([OH:9])[OH:10])[cH:6][cH:7]1.[Na+:33].[Na+:34].[O-:35][C:36](=[O:37])[O-:38].[O:116]1[CH2:117][CH2:118][CH2:119][CH2:120]1.[cH:39]1[cH:40][cH:41][c:42]([P:43]([Pd:44]([P:45]([c:46]2[cH:47][cH:48][cH:49][cH:50][cH:51]2)([c:52]2[cH:53][cH:54][cH:55][cH:56][cH:57]2)[c:58]2[cH:59][cH:60][cH:61][cH:62][cH:63]2)([P:64]([c:65]2[cH:66][cH:67][cH:68][cH:69][cH:70]2)([c:71]2[cH:72][cH:73][cH:74][cH:75][cH:76]2)[c:77]2[cH:78][cH:79][cH:80][cH:81][cH:82]2)[P:83]([c:84]2[cH:85][cH:86][cH:87][cH:88][cH:89]2)([c:90]2[cH:91][cH:92][cH:93][cH:94][cH:95]2)[c:96]2[cH:97][cH:98][cH:99][cH:100][cH:101]2)([c:102]2[cH:103][cH:104][cH:105][cH:106][cH:107]2)[c:108]2[cH:109][cH:110][cH:111][cH:112][cH:113]2)[cH:114][cH:115]1>>[F:1][c:2]1[c:3](-[c:11]2[n:12][cH:13][c:14]([F:18])[cH:15][c:16]2[F:17])[cH:4][c:5](-[c:20]2[cH:21][n:22][c:23]3[n:24]2[n:25][cH:26][c:27]([C:29]([CH3:30])([CH3:31])[OH:32])[n:28]3)[cH:6][cH:7]1