Dichloromethane → 2-Amino-1-[4-(2-trifluoromethyl-benzoyl)-piperazin-1-yl]-ethanone

HRID 687835Notes

Reaction equation

HRID 687835 reaction equation
[C:8]([O:9][C:10](=[O:11])[NH:14][CH2:15][C:16]([N:17]1[CH2:18][CH2:19][N:20]([C:23]([c:24]2[c:25]([C:30]([F:31])([F:32])[F:33])[cH:26][cH:27][cH:28][cH:29]2)=[O:34])[CH2:21][CH2:22]1)=[O:35])([CH3:12])([CH3:13])[CH3:36].[Cl:37][CH2:38][Cl:39].[F:1][C:2]([F:3])([F:4])[C:5]([OH:6])=[O:7]>>[NH2:14][CH2:15][C:16]([N:17]1[CH2:18][CH2:19][N:20]([C:23]([c:24]2[c:25]([C:30]([F:31])([F:32])[F:33])[cH:26][cH:27][cH:28][cH:29]2)=[O:34])[CH2:21][CH2:22]1)=[O:35]

Participants

4

Reactant 3

HCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 59559599{2-Oxo-2-[4-(2-trifluoromethyl-benzoyl)-piperazin-1-yl]-ethyl}-carbamic acid tert-butyl ester

Product 1

HCID 595596292-Amino-1-[4-(2-trifluoromethyl-benzoyl)-piperazin-1-yl]-ethanone

Sources & evidence

ORD record
ord-ddb97cd5108c44499314188eb0fb7a1a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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