Benzene → HCID 22508936, compound
Reaction equation
[CH3:38][CH2:39][O:40][C:41](=[O:42])[CH3:43].[Cl:1][c:2]1[n:3][c:4]([CH3:12])[n:5][c:6]([Cl:11])[c:7]1[N+:8](=[O:9])[O-:10].[F:13][C:14]([c:15]1[c:16]([B:21]([OH:22])[OH:23])[cH:17][cH:18][cH:19][cH:20]1)([F:24])[F:25].[Na+:26].[Na+:27].[O-:28][C:29](=[O:30])[O-:31].[cH:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1.[cH:44]1[cH:45][cH:46][c:47]([P:48]([Pd:49]([P:50]([c:51]2[cH:52][cH:53][cH:54][cH:55][cH:56]2)([c:57]2[cH:58][cH:59][cH:60][cH:61][cH:62]2)[c:63]2[cH:64][cH:65][cH:66][cH:67][cH:68]2)([P:69]([c:70]2[cH:71][cH:72][cH:73][cH:74][cH:75]2)([c:76]2[cH:77][cH:78][cH:79][cH:80][cH:81]2)[c:82]2[cH:83][cH:84][cH:85][cH:86][cH:87]2)[P:88]([c:89]2[cH:90][cH:91][cH:92][cH:93][cH:94]2)([c:95]2[cH:96][cH:97][cH:98][cH:99][cH:100]2)[c:101]2[cH:102][cH:103][cH:104][cH:105][cH:106]2)([c:107]2[cH:108][cH:109][cH:110][cH:111][cH:112]2)[c:113]2[cH:114][cH:115][cH:116][cH:117][cH:118]2)[cH:119][cH:120]1>>[c:2]1(-[c:16]2[c:15]([C:14]([F:13])([F:24])[F:25])[cH:20][cH:19][cH:18][cH:17]2)[n:3][c:4]([CH3:12])[n:5][c:6]([Cl:11])[c:7]1[N+:8](=[O:9])[O-:10]Participants
8
Sources & evidence
- ORD record
- ord-79e067da884a45839c1c5f4f2565008f
- Source dataset
- Test data from https://doi.org/10.1039/C8SC04228D
Reaction notes
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