Chloride → 4-(4-(1,1,1,3,3,3-Hexafluoropropane-2-yl)phenyl)benzo[d]thiazole
Reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([CH:8]([C:9]([F:10])([F:11])[F:12])[C:13]([F:14])([F:15])[F:16])[cH:6][cH:7]1.[CH2:27]1[O:28][CH2:29][CH2:30][CH2:31]1.[Cl-:32].[Cl-:34].[Cl:17][c:18]1[cH:19][cH:20][cH:21][c:22]2[c:23]1[n:24][cH:25][s:26]2.[Zn+2:33].[cH:35]1[cH:36][cH:37][c:38]([P:39]([Pd:40]([P:41]([c:42]2[cH:43][cH:44][cH:45][cH:46][cH:47]2)([c:48]2[cH:49][cH:50][cH:51][cH:52][cH:53]2)[c:54]2[cH:55][cH:56][cH:57][cH:58][cH:59]2)([P:60]([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)[c:73]2[cH:74][cH:75][cH:76][cH:77][cH:78]2)[P:79]([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)[c:92]2[cH:93][cH:94][cH:95][cH:96][cH:97]2)([c:98]2[cH:99][cH:100][cH:101][cH:102][cH:103]2)[c:104]2[cH:105][cH:106][cH:107][cH:108][cH:109]2)[cH:110][cH:111]1>>[c:2]1(-[c:18]2[cH:19][cH:20][cH:21][c:22]3[c:23]2[n:24][cH:25][s:26]3)[cH:3][cH:4][c:5]([CH:8]([C:9]([F:10])([F:11])[F:12])[C:13]([F:14])([F:15])[F:16])[cH:6][cH:7]1Participants
7
Sources & evidence
- ORD record
- ord-0c6f110ad3d64ac1b6463a0c478a1c8c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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