Methanol → 1-(2'-Fluoro-6-nitro-biphenyl-3-yl)-4-methyl-piperazine
Reaction equation
[Br:1][c:2]1[cH:3][c:4]([N:11]2[CH2:12][CH2:13][N:14]([CH3:17])[CH2:15][CH2:16]2)[cH:5][cH:6][c:7]1[N+:8](=[O:9])[O-:10].[C:28](=[O:29])([O-:30])[O-:31].[CH3:145][OH:146].[CH3:53][O:54][CH2:55][CH2:56][O:57][CH3:58].[CH3:59][CH2:60][CH2:61][CH2:62][CH2:63][CH3:64].[Cl:65][CH2:66][Cl:67].[F:18][c:19]1[c:20]([B:25]([OH:26])[OH:27])[cH:21][cH:22][cH:23][cH:24]1.[Na+:32].[Na+:33].[c:34]1([P:35]([c:36]2[cH:37][cH:38][cH:39][cH:40][cH:41]2)[c:42]2[cH:43][cH:44][cH:45][cH:46][cH:47]2)[cH:48][cH:49][cH:50][cH:51][cH:52]1.[cH:68]1[cH:69][cH:70][c:71]([P:72]([Pd:73]([P:74]([c:75]2[cH:76][cH:77][cH:78][cH:79][cH:80]2)([c:81]2[cH:82][cH:83][cH:84][cH:85][cH:86]2)[c:87]2[cH:88][cH:89][cH:90][cH:91][cH:92]2)([P:93]([c:94]2[cH:95][cH:96][cH:97][cH:98][cH:99]2)([c:100]2[cH:101][cH:102][cH:103][cH:104][cH:105]2)[c:106]2[cH:107][cH:108][cH:109][cH:110][cH:111]2)[P:112]([c:113]2[cH:114][cH:115][cH:116][cH:117][cH:118]2)([c:119]2[cH:120][cH:121][cH:122][cH:123][cH:124]2)[c:125]2[cH:126][cH:127][cH:128][cH:129][cH:130]2)([c:131]2[cH:132][cH:133][cH:134][cH:135][cH:136]2)[c:137]2[cH:138][cH:139][cH:140][cH:141][cH:142]2)[cH:143][cH:144]1>>[c:2]1(-[c:20]2[c:19]([F:18])[cH:24][cH:23][cH:22][cH:21]2)[cH:3][c:4]([N:11]2[CH2:12][CH2:13][N:14]([CH3:17])[CH2:15][CH2:16]2)[cH:5][cH:6][c:7]1[N+:8](=[O:9])[O-:10]Participants
11
Reactant 10
Product 1
Sources & evidence
- ORD record
- ord-273a48a98ffc494abd5cfbb0378d1e3a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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