Bromide ion → 2-Bromo-4-thiocyanatoaniline

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

Reactant 8

HCID 259Bromide ion

HCID 260Hydrogen Bromide

HCID 119922-Bromoaniline

HCID 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)
DOI: 10.1039/C8SC04228D

Reaction notes

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