Acetic Acid → 7-bromo-5-chloro-1H-indole-3-carbonitrile

HRID 301343

Reaction equation

HRID 301343 reaction equation
[Br:1][c:2]1[cH:3][c:4]([Cl:13])[cH:5][c:6]2[c:7]([CH:11]=[O:12])[cH:8][nH:9][c:10]12.[CH3:28][C:29](=[O:30])[OH:31].[N+:22]([CH2:23][CH2:24][CH3:25])([O-:26])=[O:27].[NH4+:19].[NH4+:20].[NH4+:21].[P:14]([O-:15])([O-:16])([O-:17])=[O:18]>>[Br:1][c:2]1[cH:3][c:4]([Cl:13])[cH:5][c:6]2[c:7]([C:11]#[N:22])[cH:8][nH:9][c:10]12

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 223Ammonium3×HCID 1061PhosphateHCID 79031-NitropropaneHCID 575461137-bromo-5-chloro-1H-indole-3-carbaldehyde

Product 1

HCID 575462207-bromo-5-chloro-1H-indole-3-carbonitrile

Sources & evidence

ORD record
ord-b8516ac1e4154dae8227faa547f4273e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Linked notes

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