Acetate → 2-Chloro-N-(3-nitrophenyl)pyridine-4-amine

HRID 1208365Notes

Reaction equation

HRID 1208365 reaction equation
[C:67](=[O:68])([O-:69])[O-:70].[CH3:73][c:74]1[cH:75][cH:76][cH:77][cH:78][cH:79]1.[Cl:3][c:4]1[n:5][cH:6][cH:7][c:8]([I:10])[cH:9]1.[Cs+:71].[Cs+:72].[N+:11](=[O:12])([O-:13])[c:14]1[cH:15][c:16]([NH2:17])[cH:18][cH:19][cH:20]1.[N:1]#[N:2].[O-:81][C:82]([CH3:83])=[O:84].[O-:85][C:86]([CH3:87])=[O:88].[Pd+2:80].[cH:21]1[cH:22][cH:23][c:24]([P:25]([c:26]2[cH:27][cH:28][c:29]3[c:30]([cH:31][cH:32][cH:33][cH:34]3)[c:35]2-[c:36]2[c:37]3[c:38]([cH:39][cH:40][cH:41][cH:42]3)[cH:43][cH:44][c:45]2[P:46]([c:47]2[cH:48][cH:49][cH:50][cH:51][cH:52]2)[c:53]2[cH:54][cH:55][cH:56][cH:57][cH:58]2)[c:59]2[cH:60][cH:61][cH:62][cH:63][cH:64]2)[cH:65][cH:66]1>>[Cl:3][c:4]1[n:5][cH:6][cH:7][c:8]([NH:17][c:16]2[cH:15][c:14]([N+:11](=[O:12])[O-:13])[cH:20][cH:19][cH:18]2)[cH:9]1

Participants

10

Reactant 9

HCID 175Acetate2×HCID 947NitrogenHCID 1140TolueneHCID 74233-NitroanilineHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 634876Binap, (A+-)-HCID 15165112-Chloro-4-iodopyridine

Product 1

HCID 581679072-Chloro-N-(3-nitrophenyl)pyridine-4-amine

Sources & evidence

ORD record
ord-5855e548f90d4e3fb7aba1240da22ac9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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