Bromide ion → 2-Bromo-4-thiocyanatoaniline

HRID 154255Notes

Reaction equation

HRID 154255 reaction equation
[Br-:15].[Br:13].[Br:1][c:2]1[c:3]([NH2:4])[cH:5][cH:6][cH:7][cH:8]1.[CH3:22][OH:23].[Na+:14].[Na+:16].[Na+:17].[Na+:9].[O-:18][C:19](=[O:20])[O-:21].[OH2:24].[S-:10][C:11]#[N:12]>>[Br:1][c:2]1[c:3]([NH2:4])[cH:5][cH:6][c:7]([S:10][C:11]#[N:12])[cH:8]1

Participants

9

Reactant 8

HCID 259Bromide ionHCID 260Hydrogen BromideHCID 887MethanolHCID 923Sodium ion4×HCID 962WaterHCID 9322ThiocyanateHCID 119922-BromoanilineHCID 19660Carbonate Ion

Product 1

HCID 38124212-Bromo-4-thiocyanatoaniline

Sources & evidence

ORD record
ord-b471a122a2d240d2b0438e731296fc9d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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