Potassium Cation → 2-(4-Propylphenyl)-1,7,8-trifluoronaphthalene
Reaction equation
[C:35](=[O:36])([O-:37])[O-:38].[CH2:22]([CH2:23][CH3:24])[c:25]1[cH:26][cH:27][c:28]([O:31][B:32]([OH:33])[OH:34])[cH:29][cH:30]1.[CH3:41][c:42]1[cH:43][cH:44][cH:45][cH:46][cH:47]1.[F:1][C:2]([F:3])([F:4])[S:5]([O:6][c:7]1[c:8]([F:19])[c:9]2[c:10]([F:18])[c:11]([F:17])[cH:12][cH:13][c:14]2[cH:15][cH:16]1)(=[O:20])=[O:21].[K+:39].[K+:40].[O:126]1[CH2:127][CH2:128][CH2:129][CH2:130]1.[OH2:125].[cH:48]1[cH:49][cH:50][c:51]([P:52]([Pd:53]([P:54]([c:55]2[cH:56][cH:57][cH:58][cH:59][cH:60]2)([c:61]2[cH:62][cH:63][cH:64][cH:65][cH:66]2)[c:67]2[cH:68][cH:69][cH:70][cH:71][cH:72]2)([P:73]([c:74]2[cH:75][cH:76][cH:77][cH:78][cH:79]2)([c:80]2[cH:81][cH:82][cH:83][cH:84][cH:85]2)[c:86]2[cH:87][cH:88][cH:89][cH:90][cH:91]2)[P:92]([c:93]2[cH:94][cH:95][cH:96][cH:97][cH:98]2)([c:99]2[cH:100][cH:101][cH:102][cH:103][cH:104]2)[c:105]2[cH:106][cH:107][cH:108][cH:109][cH:110]2)([c:111]2[cH:112][cH:113][cH:114][cH:115][cH:116]2)[c:117]2[cH:118][cH:119][cH:120][cH:121][cH:122]2)[cH:123][cH:124]1>>[c:7]1(-[c:28]2[cH:27][cH:26][c:25]([CH2:22][CH2:23][CH3:24])[cH:30][cH:29]2)[c:8]([F:19])[c:9]2[c:10]([F:18])[c:11]([F:17])[cH:12][cH:13][c:14]2[cH:15][cH:16]1Participants
9
Sources & evidence
- ORD record
- ord-54b97a79a39b4971a8c2d9d01fc809be
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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