Carbonate Ion → 4-(2-Methoxy-4-nitrophenyl)-6-methylpyridazine 1-oxide

HRID 1570253Notes

Reaction equation

HRID 1570253 reaction equation
[Br:21][c:22]1[cH:23][n:24][n+:25]([O-:29])[c:26]([CH3:28])[cH:27]1.[C:30](=[O:31])([O-:32])[O-:33].[CH2:36]1[O:37][CH2:38][CH2:39][O:40][CH2:41]1.[CH3:1][O:2][c:3]1[c:4]([B:12]2[O:13][C:14]([CH3:15])([CH3:16])[C:17]([CH3:18])([CH3:19])[O:20]2)[cH:5][cH:6][c:7]([N+:9](=[O:10])[O-:11])[cH:8]1.[Cs+:34].[Cs+:35]>>[CH3:1][O:2][c:3]1[c:4](-[c:22]2[cH:23][n:24][n+:25]([O-:29])[c:26]([CH3:28])[cH:27]2)[cH:5][cH:6][c:7]([N+:9](=[O:10])[O-:11])[cH:8]1

Participants

6

Reactant 5

HCID 19660Carbonate IonHCID 312751,4-DioxaneHCID 104967Cesium cation2×HCID 667086722-(2-Methoxy-4-nitrophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolaneHCID 668589204-Bromo-6-methylpyridazine 1-oxide

Product 1

HCID 668579934-(2-Methoxy-4-nitrophenyl)-6-methylpyridazine 1-oxide

Sources & evidence

ORD record
ord-ec5c8f8721de4fa48eb75d442b231890
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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