Hydrochloric Acid → 2-(2-Chloro-5-fluoropyrimidin-4-yl)-benzo[b]thiophene-4-carboxylic acid
Reaction equation
[C:1](=[O:2])([O-:3])[O-:4].[C:7](=[O:8])([OH:9])[c:10]1[cH:11][cH:12][cH:13][c:14]2[s:15][c:16]([B:19]([OH:20])[OH:21])[cH:17][c:18]12.[CH3:32][O:33][CH2:34][CH2:35][O:36][CH3:37].[Cl:22][c:23]1[n:24][cH:25][c:26]([F:30])[c:27]([Cl:29])[n:28]1.[ClH:31].[Na+:5].[Na+:6].[Pd:38]([Cl:39])[Cl:40].[c:41]1([P:42]([c:43]2[cH:44][cH:45][cH:46][cH:47][cH:48]2)[c:49]2[cH:50][cH:51][cH:52][cH:53][cH:54]2)[cH:55][cH:56][cH:57][cH:58][cH:59]1.[c:60]1([P:61]([c:62]2[cH:63][cH:64][cH:65][cH:66][cH:67]2)[c:68]2[cH:69][cH:70][cH:71][cH:72][cH:73]2)[cH:74][cH:75][cH:76][cH:77][cH:78]1>>[C:7](=[O:8])([OH:9])[c:10]1[cH:11][cH:12][cH:13][c:14]2[s:15][c:16](-[c:27]3[c:26]([F:30])[cH:25][n:24][c:23]([Cl:22])[n:28]3)[cH:17][c:18]12Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-5e9adc0a2d03400c818a6c55328f6b62
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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