Benzene → 2'-Trifluoromethyl-biphenyl-4-ylamine
Reaction equation
[Br-:34].[Br:1][c:2]1[cH:3][cH:4][c:5]([NH2:6])[cH:7][cH:8]1.[CH2:52]([Cl:53])[Cl:54].[CH3:35][CH2:36][CH2:37][CH2:38][N+:39]([CH2:40][CH2:41][CH2:42][CH3:43])([CH2:44][CH2:45][CH2:46][CH3:47])[CH2:48][CH2:49][CH2:50][CH3:51].[F:9][C:10]([c:11]1[c:12]([B:17]([OH:18])[OH:19])[cH:13][cH:14][cH:15][cH:16]1)([F:20])[F:21].[Na+:22].[Na+:23].[O-:24][C:25](=[O:26])[O-:27].[OH2:55].[Pd:56].[c:114]1([P:115]([c:116]2[cH:117][cH:118][cH:119][cH:120][cH:121]2)[c:122]2[cH:123][cH:124][cH:125][cH:126][cH:127]2)[cH:128][cH:129][cH:130][cH:131][cH:132]1.[c:57]1([P:58]([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)[cH:71][cH:72][cH:73][cH:74][cH:75]1.[c:76]1([P:77]([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)[cH:90][cH:91][cH:92][cH:93][cH:94]1.[c:95]1([P:96]([c:97]2[cH:98][cH:99][cH:100][cH:101][cH:102]2)[c:103]2[cH:104][cH:105][cH:106][cH:107][cH:108]2)[cH:109][cH:110][cH:111][cH:112][cH:113]1.[cH:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1>>[c:2]1(-[c:12]2[c:11]([C:10]([F:9])([F:20])[F:21])[cH:16][cH:15][cH:14][cH:13]2)[cH:3][cH:4][c:5]([NH2:6])[cH:7][cH:8]1Participants
12
Reactant 11
Product 1
Sources & evidence
- ORD record
- ord-83ac3b713c9c485aa173d21e2b43617b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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