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Acetone → 2-(Methylthio)-4-(trifluoromethyl)benzonitrile

HRID 112701
Notes
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Reaction equation

HRID 112701 reaction equation
[CH3:17][C:18](=[O:19])[CH3:20].[CH3:1][S-:2].[Cl:4][c:5]1[c:6]([C:7]#[N:8])[cH:9][cH:10][c:11]([C:13]([F:14])([F:15])[F:16])[cH:12]1.[Na+:3]>>[CH3:1][S:2][c:5]1[c:6]([C:7]#[N:8])[cH:9][cH:10][c:11]([C:13]([F:14])([F:15])[F:16])[cH:12]1
ParticipantsSources & evidenceReaction notes

Participants

5

Reactant 4

HCID 180AcetoneHCID 923Sodium IonHCID 519392MercaptomethanideHCID 27364762-Chloro-4-(trifluoromethyl)benzonitrile

Product 1

HCID 111068072-(Methylthio)-4-(trifluoromethyl)benzonitrile

Sources & evidence

ORD record
ord-7f81e128257b4ab1945d94e67462cfcd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes