Sodium ion → 4-Chloro-2-methyl-6-phenyl-pyrimidin-5-ylamine

HRID 95557

Reaction equation

HRID 95557 reaction equation
[CH3:26][O:27][CH2:28][CH2:29][O:30][CH3:31].[Cl:1][c:2]1[n:3][c:4]([CH3:10])[n:5][c:6]([Cl:9])[c:7]1[NH2:8].[Na+:20].[Na+:21].[O-:22][C:23](=[O:24])[O-:25].[OH:11][B:12]([OH:13])[c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1.[cH:32]1[cH:33][cH:34][c:35]([P:36]([Pd:37]([P:38]([c:39]2[cH:40][cH:41][cH:42][cH:43][cH:44]2)([c:45]2[cH:46][cH:47][cH:48][cH:49][cH:50]2)[c:51]2[cH:52][cH:53][cH:54][cH:55][cH:56]2)([P:57]([c:58]2[cH:59][cH:60][cH:61][cH:62][cH:63]2)([c:64]2[cH:65][cH:66][cH:67][cH:68][cH:69]2)[c:70]2[cH:71][cH:72][cH:73][cH:74][cH:75]2)[P:76]([c:77]2[cH:78][cH:79][cH:80][cH:81][cH:82]2)([c:83]2[cH:84][cH:85][cH:86][cH:87][cH:88]2)[c:89]2[cH:90][cH:91][cH:92][cH:93][cH:94]2)([c:95]2[cH:96][cH:97][cH:98][cH:99][cH:100]2)[c:101]2[cH:102][cH:103][cH:104][cH:105][cH:106]2)[cH:107][cH:108]1>>[c:2]1(-[c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[n:3][c:4]([CH3:10])[n:5][c:6]([Cl:9])[c:7]1[NH2:8]

Participants

7

Reactant 6

HCID 923Sodium ion2×HCID 80711,2-DimethoxyethaneHCID 19660Carbonate IonHCID 66827Phenylboronic AcidHCID 7366744,6-Dichloro-2-methylpyrimidin-5-amineHCID 178420554HCID 178420554, compound

Product 1

HCID 598466394-Chloro-2-methyl-6-phenyl-pyrimidin-5-ylamine

Sources & evidence

ORD record
ord-7710002a811a4aceb5061d68836a599d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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