Chloride → 5-Bromo-6-methoxy-isoquinoline

HRID 88255

Reaction equation

HRID 88255 reaction equation
[Al+3:14].[Br:17][Br:18].[C:19](=[O:20])([O-:21])[O-:22].[CH3:1][O:2][c:3]1[cH:4][c:5]2[cH:6][cH:7][n:8][cH:9][c:10]2[cH:11][cH:12]1.[Cl-:13].[Cl-:15].[Cl-:16].[Cl:25][CH2:26][Cl:27].[Na+:23].[Na+:24].[OH2:28]>>[CH3:1][O:2][c:3]1[c:4]([Br:17])[c:5]2[cH:6][cH:7][n:8][cH:9][c:10]2[cH:11][cH:12]1

Participants

9

Reactant 8

HCID 312Chloride3×HCID 923Sodium ion2×HCID 962WaterHCID 6344DichloromethaneHCID 19660Carbonate IonHCID 24408BromineHCID 104727Aluminum CationHCID 110409786-Methoxyisoquinoline

Product 1

HCID 222265455-Bromo-6-methoxy-isoquinoline

Sources & evidence

ORD record
ord-a5edfbf152914c5caf39c1c990e5b7d5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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