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Ammonium → 2,2-Dimethyl-4-(5-fluoro-2-methylphenyl)-5-oxopiperazine-1-carboxylic acid t-butyl ester

HRID 161763
Notes
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Reaction equation

HRID 161763 reaction equation
[C:7]([CH3:8])([CH3:9])([CH3:10])[O:11][C:12]([NH:13][C:14]([CH2:15][N:16]([c:17]1[c:18]([CH3:24])[cH:19][cH:20][c:21]([F:23])[cH:22]1)[C:25]([CH2:26][Br:27])=[O:28])([CH3:29])[CH3:30])=[O:31].[CH3:1][C:2]([CH3:3])([O-:4])[CH3:5].[Cl-:32].[K+:6].[NH4+:33].[O:34]1[CH2:35][CH2:36][CH2:37][CH2:38]1.[OH2:39]>>[C:7]([CH3:8])([CH3:9])([CH3:10])[O:11][C:12]([N:13]1[C:14]([CH3:29])([CH3:30])[CH2:15][N:16]([c:17]2[c:18]([CH3:24])[cH:19][cH:20][c:21]([F:23])[cH:22]2)[C:25](=[O:28])[CH2:26]1)=[O:31]
ParticipantsSources & evidenceReaction notes

Participants

8

Reactant 7

HCID 223AmmoniumHCID 312ChlorideHCID 813Potassium CationHCID 962WaterHCID 8028TetrahydrofuranHCID 45749132-Methylpropan-2-olateHCID 66645460{2-[(2-Bromoacetyl)-(5-fluoro-2-methylphenyl)amino]-1,1-dimethylethyl}carbamic acid t-butyl ester

Product 1

HCID 666457692,2-Dimethyl-4-(5-fluoro-2-methylphenyl)-5-oxopiperazine-1-carboxylic acid t-butyl ester

Sources & evidence

ORD record
ord-c7f6b4a489ba4b16997d9641e4d4807e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes