Ethanol → HCID 11631329, compound

HRID 296648Notes

Reaction equation

HRID 296648 reaction equation
[Br:1][c:2]1[cH:3][c:4]([C:12]([F:13])([F:14])[F:15])[cH:5][c:6]2[nH:7][c:8](=[O:11])[nH:9][c:10]12.[CH2:28]([CH2:29][O:30][CH3:31])[O:32][CH3:33].[CH3:76][CH2:77][OH:78].[F:16][c:17]1[cH:18][c:19]([B:25]([OH:26])[OH:27])[cH:20][c:21]([F:24])[c:22]1[F:23].[OH2:34].[Pd:35]([Cl:36])[Cl:37].[c:38]1([P:39]([c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)[c:46]2[cH:47][cH:48][cH:49][cH:50][cH:51]2)[cH:52][cH:53][cH:54][cH:55][cH:56]1.[c:57]1([P:58]([c:59]2[cH:60][cH:61][cH:62][cH:63][cH:64]2)[c:65]2[cH:66][cH:67][cH:68][cH:69][cH:70]2)[cH:71][cH:72][cH:73][cH:74][cH:75]1>>[c:2]1(-[c:19]2[cH:18][c:17]([F:16])[c:22]([F:23])[c:21]([F:24])[cH:20]2)[cH:3][c:4]([C:12]([F:13])([F:14])[F:15])[cH:5][c:6]2[nH:7][c:8](=[O:11])[nH:9][c:10]12

Participants

8

Reactant 7

HCID 702EthanolHCID 962WaterHCID 80711,2-DimethoxyethaneHCID 11776Triphenylphosphine2×HCID 24290Palladium ChlorideHCID 2734671(3,4,5-Trifluorophenyl)boronic Acid (contains varying amounts of Anhydride)HCID 115800214-bromo-6-trifluoromethyl-1,3-dihydrobenzoimidazol-2-one

Product 1

HCID 11631329HCID 11631329, compound

Sources & evidence

ORD record
ord-52245acd314c4931b6417548608fd7ef
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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