Toluene → HCID 18182276, compound
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[c:9]([C:15]#[C:16][C:17]2([OH:25])[CH2:18][N:19]3[CH2:20][CH2:21][CH:22]2[CH2:23][CH2:24]3)[n:10][cH:11][c:12]([Br:14])[cH:13]1.[CH3:122][c:123]1[cH:124][cH:125][cH:126][cH:127][cH:128]1.[cH:45]1[cH:46][cH:47][c:48]([P:49]([Pd:50]([P:51]([c:52]2[cH:53][cH:54][cH:55][cH:56][cH:57]2)([c:58]2[cH:59][cH:60][cH:61][cH:62][cH:63]2)[c:64]2[cH:65][cH:66][cH:67][cH:68][cH:69]2)([P:70]([c:71]2[cH:72][cH:73][cH:74][cH:75][cH:76]2)([c:77]2[cH:78][cH:79][cH:80][cH:81][cH:82]2)[c:83]2[cH:84][cH:85][cH:86][cH:87][cH:88]2)[P:89]([c:90]2[cH:91][cH:92][cH:93][cH:94][cH:95]2)([c:96]2[cH:97][cH:98][cH:99][cH:100][cH:101]2)[c:102]2[cH:103][cH:104][cH:105][cH:106][cH:107]2)([c:108]2[cH:109][cH:110][cH:111][cH:112][cH:113]2)[c:114]2[cH:115][cH:116][cH:117][cH:118][cH:119]2)[cH:120][cH:121]1.[n:26]1[c:27]([Sn:32]([CH2:33][CH2:34][CH2:35][CH3:36])([CH2:37][CH2:38][CH2:39][CH3:40])[CH2:41][CH2:42][CH2:43][CH3:44])[cH:28][cH:29][cH:30][cH:31]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[c:9]([C:15]#[C:16][C:17]2([OH:25])[CH2:18][N:19]3[CH2:20][CH2:21][CH:22]2[CH2:23][CH2:24]3)[n:10][cH:11][c:12](-[c:27]2[n:26][cH:31][cH:30][cH:29][cH:28]2)[cH:13]1Participants
5
Sources & evidence
- ORD record
- ord-2340c18fe2604cdcb6a491c4e25a5e51
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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