1,2-Dichloroethane → N-(1-ethylpropyl)-3,4,5-trifluoroaniline

HRID 178477Notes

Reaction equation

HRID 178477 reaction equation
[C:11]([O:12][BH-:13]([O:14][C:15](=[O:16])[CH3:17])[O:18][C:19](=[O:20])[CH3:21])(=[O:22])[CH3:23].[CH3:1][CH2:2][C:3]([CH2:4][CH3:5])=[O:6].[CH3:7][C:8](=[O:9])[OH:10].[Cl:35][CH2:36][CH2:37][Cl:38].[F:25][c:26]1[cH:27][c:28]([NH2:29])[cH:30][c:31]([F:34])[c:32]1[F:33].[Na+:24]>>[CH3:1][CH2:2][CH:3]([CH2:4][CH3:5])[NH:29][c:28]1[cH:27][c:26]([F:25])[c:32]([F:33])[c:31]([F:34])[cH:30]1

Participants

7

Reactant 6

HCID 111,2-DichloroethaneHCID 176Acetic AcidHCID 923Sodium ionHCID 7288Ethyl ketoneHCID 2724942TriacetoxyborohydrideHCID 27249913,4,5-Trifluoroaniline

Product 1

HCID 23117858N-(1-ethylpropyl)-3,4,5-trifluoroaniline

Sources & evidence

ORD record
ord-539f3c435eca4164979b63158af78b19
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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