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Acetic Acid → 3-(4-chloro-3-ethylphenoxy)-N-[[3-(1,1,2,2-tetrafluoroethoxy)phenyl]methyl]aniline

HRID 2349698
Notes
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Reaction equation

HRID 2349698 reaction equation
[CH3:33][C:34](=[O:35])[OH:36].[Cl:1][c:2]1[c:3]([CH2:16][CH3:17])[cH:4][c:5]([O:6][c:7]2[cH:8][c:9]([NH2:10])[cH:11][cH:12][cH:13]2)[cH:14][cH:15]1.[Cl:40][CH:41]([Cl:42])[CH3:43].[ClH:37].[F:18][C:19]([CH:20]([F:21])[F:22])([O:23][c:24]1[cH:25][c:26]([CH:27]=[O:28])[cH:29][cH:30][cH:31]1)[F:32].[Na+:39].[OH-:38]>>[Cl:1][c:2]1[c:3]([CH2:16][CH3:17])[cH:4][c:5]([O:6][c:7]2[cH:8][c:9]([NH:10][CH2:27][c:26]3[cH:25][c:24]([O:23][C:19]([F:18])([CH:20]([F:21])[F:22])[F:32])[cH:31][cH:30][cH:29]3)[cH:11][cH:12][cH:13]2)[cH:14][cH:15]1
ParticipantsSources & evidenceReaction notes

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 313Hydrochloric AcidHCID 923Sodium IonHCID 961HydroxideHCID 63651,1-DichloroethaneHCID 118803Benzaldehyde, 3-(1,1,2,2-tetrafluoroethoxy)-HCID 110212303-(4-Chloro-3-ethylphenoxy)aniline

Product 1

HCID 109285193-(4-chloro-3-ethylphenoxy)-N-[[3-(1,1,2,2-tetrafluoroethoxy)phenyl]methyl]aniline

Sources & evidence

ORD record
ord-6a9dd198532f4338b8fc9fc1c1265c81
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes