Propargyl alcohol → 3-(4-bromophenyl)prop-2-yn-1-ol
Reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([I:8])[cH:6][cH:7]1.[CH2:9]([C:10]#[CH:11])[OH:12].[CH3:13][CH2:14][N:15]([CH2:16][CH3:17])[CH2:18][CH3:19].[cH:20]1[cH:21][cH:22][c:23]([P:24]([Pd:25]([P:26]([c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)([c:33]2[cH:34][cH:35][cH:36][cH:37][cH:38]2)[c:39]2[cH:40][cH:41][cH:42][cH:43][cH:44]2)([P:45]([c:46]2[cH:47][cH:48][cH:49][cH:50][cH:51]2)([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)[P:64]([c:65]2[cH:66][cH:67][cH:68][cH:69][cH:70]2)([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)[c:89]2[cH:90][cH:91][cH:92][cH:93][cH:94]2)[cH:95][cH:96]1>>[Br:1][c:2]1[cH:3][cH:4][c:5]([C:11]#[C:10][CH2:9][OH:12])[cH:6][cH:7]1Participants
5
Sources & evidence
- ORD record
- ord-46b9414f12ba4a0e9703b6e4b623e988
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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