Cyanide → 4,5-Difluoro-2-(pyridin-2-yloxy)benzonitrile
Reaction equation
[Br:1][c:2]1[c:3]([O:4][c:5]2[n:6][cH:7][cH:8][cH:9][cH:10]2)[cH:11][c:12]([F:16])[c:13]([F:15])[cH:14]1.[C-:22]#[N:23].[C-:25]#[N:26].[CH3:17][N:18]([CH3:19])[CH:20]=[O:21].[Zn+2:24].[cH:27]1[cH:28][cH:29][c:30]([P:31]([Pd:32]([P:33]([c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)([c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)[c:46]2[cH:47][cH:48][cH:49][cH:50][cH:51]2)([P:52]([c:53]2[cH:54][cH:55][cH:56][cH:57][cH:58]2)([c:59]2[cH:60][cH:61][cH:62][cH:63][cH:64]2)[c:65]2[cH:66][cH:67][cH:68][cH:69][cH:70]2)[P:71]([c:72]2[cH:73][cH:74][cH:75][cH:76][cH:77]2)([c:78]2[cH:79][cH:80][cH:81][cH:82][cH:83]2)[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)[cH:102][cH:103]1>>[c:2]1([C:17]#[N:18])[c:3]([O:4][c:5]2[n:6][cH:7][cH:8][cH:9][cH:10]2)[cH:11][c:12]([F:16])[c:13]([F:15])[cH:14]1Participants
6
Sources & evidence
- ORD record
- ord-d9da76e4f8764adeaa75af22de2b3386
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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