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Bromide ion → 2-(4-Chloro-2-fluoro-5-methoxyphenyl)-4-(difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one

HRID 936828
Notes
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Reaction equation

HRID 936828 reaction equation
[Br-:24].[CH2:42]1[CH2:43][CH2:44][CH2:45][CH2:46][CH2:47]1.[CH3:25][CH2:26][CH2:27][CH2:28][N+:29]([CH2:30][CH2:31][CH2:32][CH3:33])([CH2:34][CH2:35][CH2:36][CH3:37])[CH2:38][CH2:39][CH2:40][CH3:41].[Cl:1][c:2]1[cH:3][c:4]([F:17])[c:5](-[n:10]2[n:11][c:12]([CH3:16])[nH:13][c:14]2=[O:15])[cH:6][c:7]1[O:8][CH3:9].[Cl:20][CH:21]([F:22])[F:23].[Na+:19].[OH-:18]>>[Cl:1][c:2]1[cH:3][c:4]([F:17])[c:5](-[n:10]2[n:11][c:12]([CH3:16])[n:13]([CH:21]([F:22])[F:23])[c:14]2=[O:15])[cH:6][c:7]1[O:8][CH3:9]
ParticipantsSources & evidenceReaction notes

Participants

8

Reactant 7

HCID 259Bromide ionHCID 923Sodium IonHCID 961HydroxideHCID 6372ChlorodifluoromethaneHCID 8078CyclohexaneHCID 16028TetrabutylammoniumHCID 135688047HCID 135688047, compound

Product 1

HCID 139618062-(4-Chloro-2-fluoro-5-methoxyphenyl)-4-(difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one

Sources & evidence

ORD record
ord-1fb848cfa44543b8ad6b679ebaf474e4
Source dataset
Validation data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes