Dichloromethane → 3-fluoro-2-methyl-4-(trifluoromethyl)-1H-indole-5-carbonitrile

HRID 114915

Reaction equation

[CH3:1][c:2]1[nH:3][c:4]2[cH:5][cH:6][c:7]([C:15]#[N:16])[c:8]([C:11]([F:12])([F:13])[F:14])[c:9]2[cH:10]1.[Cl:32][CH2:33][Cl:34].[F:25][n+:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1.[S:17]([O-:18])([C:19]([F:20])([F:21])[F:22])(=[O:23])=[O:24]>>[CH3:1][c:2]1[nH:3][c:4]2[cH:5][cH:6][c:7]([C:15]#[N:16])[c:8]([C:11]([F:12])([F:13])[F:14])[c:9]2[c:10]1[F:21]

Participants

Reactant 4

HCID 6344Dichloromethane

HCID 2724577Pyridinium, 1-fluoro-

HCID 2758875Trifluoromethanesulfonate

HCID 533093462-methyl-4-(trifluoromethyl)-1H-indole-5-carbonitrile

Product 1

HCID 578003103-fluoro-2-methyl-4-(trifluoromethyl)-1H-indole-5-carbonitrile

Sources & evidence

ORD record: ord-84d140e75616453696a695e998fa13a8
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

Linked notes

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