Toluene → HCID 68461208, compound
Reaction equation
[CH2:15]([Sn:16]([CH2:17][CH2:18][CH2:19][CH3:26])([c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1)[CH2:27][CH2:28][CH2:29][CH3:30])[CH2:31][CH2:32][CH3:33].[CH3:34][c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1.[Cl:1][c:2]1[n:3][c:4](-[n:8]2[c:9]([CH3:14])[cH:10][cH:11][c:12]2[CH3:13])[cH:5][cH:6][cH:7]1.[Pd:41].[c:42]1([P:43]([c:44]2[cH:45][cH:46][cH:47][cH:48][cH:49]2)[c:50]2[cH:51][cH:52][cH:53][cH:54][cH:55]2)[cH:56][cH:57][cH:58][cH:59][cH:60]1.[c:61]1([P:62]([c:63]2[cH:64][cH:65][cH:66][cH:67][cH:68]2)[c:69]2[cH:70][cH:71][cH:72][cH:73][cH:74]2)[cH:75][cH:76][cH:77][cH:78][cH:79]1.[c:80]1([P:81]([c:82]2[cH:83][cH:84][cH:85][cH:86][cH:87]2)[c:88]2[cH:89][cH:90][cH:91][cH:92][cH:93]2)[cH:94][cH:95][cH:96][cH:97][cH:98]1.[c:99]1([P:100]([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)[cH:113][cH:114][cH:115][cH:116][cH:117]1>>[c:2]1(-[c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[n:3][c:4](-[n:8]2[c:9]([CH3:14])[cH:10][cH:11][c:12]2[CH3:13])[cH:5][cH:6][cH:7]1Participants
6
Sources & evidence
- ORD record
- ord-fb42a38f77fa4ee8a8447a25bd831a5b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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