Hydrochloric Acid → 3-Amino-4-(2,5-dimethylphenylthio)benzonitrile

HRID 1147141Notes

Reaction equation

HRID 1147141 reaction equation
[CH3:27][CH2:28][OH:29].[CH3:6][c:7]1[c:8]([S:14][c:15]2[c:16]([N+:23]([O-:24])=[O:25])[cH:17][c:18]([C:19]#[N:20])[cH:21][cH:22]2)[cH:9][c:10]([CH3:13])[cH:11][cH:12]1.[ClH:30].[OH2:1].[OH2:26].[OH2:2].[Sn:3]([Cl:4])[Cl:5]>>[CH3:6][c:7]1[c:8]([S:14][c:15]2[c:16]([NH2:23])[cH:17][c:18]([C:19]#[N:20])[cH:21][cH:22]2)[cH:9][c:10]([CH3:13])[cH:11][cH:12]1

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 702EthanolHCID 962Water3×HCID 24479Stannous ChlorideHCID 291067464-(2,5-Dimethylphenylthio)-3-nitrobenzonitrile

Product 1

HCID 435183713-Amino-4-(2,5-dimethylphenylthio)benzonitrile

Sources & evidence

ORD record
ord-2843b253df4c4dc089d3934403a7eaaf
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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