Isopropanol → HCID 67104656, compound
Reaction equation
[Br:1][c:2]1[cH:3][c:4]2[cH:5][cH:6][c:7]([CH2:12][CH2:13][OH:14])[cH:8][c:9]2[cH:10][cH:11]1.[C:15](#[N:16])[c:17]1[cH:18][cH:19][c:20]([B:23]([OH:24])[OH:25])[cH:21][cH:22]1.[CH:26]([OH:27])([CH3:28])[CH3:29].[Pd:30]([Cl:31])[Cl:32].[c:33]1([P:34]([c:35]2[cH:36][cH:37][cH:38][cH:39][cH:40]2)[c:41]2[cH:42][cH:43][cH:44][cH:45][cH:46]2)[cH:47][cH:48][cH:49][cH:50][cH:51]1.[c:52]1([P:53]([c:54]2[cH:55][cH:56][cH:57][cH:58][cH:59]2)[c:60]2[cH:61][cH:62][cH:63][cH:64][cH:65]2)[cH:66][cH:67][cH:68][cH:69][cH:70]1>>[c:2]1(-[c:20]2[cH:19][cH:18][c:17]([C:15]#[N:16])[cH:22][cH:21]2)[cH:3][c:4]2[cH:5][cH:6][c:7]([CH2:12][CH2:13][OH:14])[cH:8][c:9]2[cH:10][cH:11]1Participants
6
Sources & evidence
- ORD record
- ord-cc3eb4bc3f90475888ea44b6d0badc37
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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