Dichloromethane → Tert-butyl 4-(4-amino-3-fluorobenzoyl)piperazine-1-carboxylate

HRID 183985

Reaction equation

HRID 183985 reaction equation
[CH2:1]([P:2]([OH:3])(=[O:4])[OH:5])[CH2:6][CH3:7].[CH3:32][CH2:33][N:34]([CH2:35][CH3:36])[CH2:37][CH3:38].[Cl:39][CH2:40][Cl:41].[N:19]1([C:25](=[O:26])[O:27][C:28]([CH3:29])([CH3:30])[CH3:31])[CH2:20][CH2:21][NH:22][CH2:23][CH2:24]1.[NH2:8][c:9]1[c:10]([F:18])[cH:11][c:12]([C:13](=[O:14])[OH:15])[cH:16][cH:17]1>>[NH2:8][c:9]1[c:10]([F:18])[cH:11][c:12]([C:13](=[O:15])[N:22]2[CH2:21][CH2:20][N:19]([C:25](=[O:26])[O:27][C:28]([CH3:29])([CH3:30])[CH3:31])[CH2:24][CH2:23]2)[cH:16][cH:17]1

Participants

6

Reactant 5

HCID 6344DichloromethaneHCID 8471TriethylamineHCID 99714-Amino-3-fluorobenzoic acidHCID 143452tert-Butyl piperazine-1-carboxylateHCID 204484Propylphosphonic acid

Product 1

HCID 58055815Tert-butyl 4-(4-amino-3-fluorobenzoyl)piperazine-1-carboxylate

Sources & evidence

ORD record
ord-a4ff017a0e05496ba4e546483618f530
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

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