Acetate → 4-Chloro-6-[5-chloro-2-(2,2,2-trifluoro-ethoxy)-phenyl]-pyrimidin-2-ylamine

HRID 834489

Reaction equation

HRID 834489 reaction equation
[C:58]([O-:59])(=[O:60])[CH3:61].[C:63]([O-:64])(=[O:65])[CH3:66].[CH3:26][C:27]([OH:28])([CH3:29])[CH2:30][OH:31].[Cl:17][c:18]1[n:19][c:20]([NH2:25])[n:21][c:22]([Cl:24])[cH:23]1.[Cl:1][c:2]1[cH:3][cH:4][c:5]([O:11][CH2:12][C:13]([F:14])([F:15])[F:16])[c:6]([B:8]([OH:9])[OH:10])[cH:7]1.[Na+:32].[Na+:33].[O-:34][C:35](=[O:36])[O-:37].[OH2:57].[Pd+2:62].[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>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([O:11][CH2:12][C:13]([F:14])([F:15])[F:16])[c:6](-[c:22]2[n:21][c:20]([NH2:25])[n:19][c:18]([Cl:17])[cH:23]2)[cH:7]1

Participants

10

Reactant 9

HCID 175Acetate2×HCID 923Sodium ion2×HCID 962WaterHCID 11776TriphenylphosphineHCID 19660Carbonate IonHCID 655222-Amino-4,6-dichloropyrimidineHCID 684102-Methylpropane-1,2-diolHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 689852805-Chloro-2-(2,2,2-trifluoro-ethoxy)-phenylboronic acid

Product 1

HCID 860043624-Chloro-6-[5-chloro-2-(2,2,2-trifluoro-ethoxy)-phenyl]-pyrimidin-2-ylamine

Sources & evidence

ORD record
ord-10a801eea4ca4f71b2d0500d120cfdcd
Source dataset
Test data from https://doi.org/10.1039/C8SC04228D

Linked notes

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