Bicarbonate Ion → 4-Chloro-6-(2-Methoxyphenyl)pyrimidin-2-Amine

HRID 1142649Notes

Reaction equation

HRID 1142649 reaction equation
[CH2:21]([CH2:22][O:23][CH3:24])[O:25][CH3:26].[CH3:10][O:11][c:12]1[c:13]([B:18]([OH:19])[OH:20])[cH:14][cH:15][cH:16][cH:17]1.[Cl:1][c:2]1[n:3][c:4]([NH2:9])[n:5][c:6]([Cl:8])[cH:7]1.[Na+:31].[O-:27][C:28]([OH:29])=[O:30].[OH2:73].[Pd:32]([Cl:33])[Cl:34].[c:35]1([P:36]([c:37]2[cH:38][cH:39][cH:40][cH:41][cH:42]2)[c:43]2[cH:44][cH:45][cH:46][cH:47][cH:48]2)[cH:49][cH:50][cH:51][cH:52][cH:53]1.[c:54]1([P:55]([c:56]2[cH:57][cH:58][cH:59][cH:60][cH:61]2)[c:62]2[cH:63][cH:64][cH:65][cH:66][cH:67]2)[cH:68][cH:69][cH:70][cH:71][cH:72]1>>[Cl:1][c:2]1[n:3][c:4]([NH2:9])[n:5][c:6](-[c:13]2[c:12]([O:11][CH3:10])[cH:17][cH:16][cH:15][cH:14]2)[cH:7]1

Participants

9

Reactant 8

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 962WaterHCID 80711,2-DimethoxyethaneHCID 11776Triphenylphosphine2×HCID 24290Palladium ChlorideHCID 655222-Amino-4,6-dichloropyrimidineHCID 27339582-Methoxyphenylboronic acid

Product 1

HCID 468615524-Chloro-6-(2-Methoxyphenyl)pyrimidin-2-Amine

Sources & evidence

ORD record
ord-5707bb24ca444238853decb8ed7f56d1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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