Dichloromethane → 2-(Piperazine-1-carbonyl)-benzoic acid methyl ester

HRID 1561972Notes

Reaction equation

HRID 1561972 reaction equation
[C:8]([O:9][C:10](=[O:11])[N:15]1[CH2:16][CH2:17][N:18]([C:21]([c:22]2[c:23]([C:28](=[O:29])[O:30][CH3:31])[cH:24][cH:25][cH:26][cH:27]2)=[O:32])[CH2:19][CH2:20]1)([CH3:12])([CH3:13])[CH3:14].[CH:33]([N:34]([CH2:35][CH3:36])[CH:37]([CH3:38])[CH3:39])([CH3:40])[CH3:41].[Cl:42][CH2:43][Cl:44].[F:1][C:2]([F:3])([F:4])[C:5]([OH:6])=[O:7]>>[NH:15]1[CH2:16][CH2:17][N:18]([C:21]([c:22]2[c:23]([C:28](=[O:29])[O:30][CH3:31])[cH:24][cH:25][cH:26][cH:27]2)=[O:32])[CH2:19][CH2:20]1

Participants

5

Reactant 4

HCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 81531DiisopropylethylamineHCID 59559652tert-Butyl 4-{[2-(methoxycarbonyl)phenyl]carbonyl}piperazine-1-carboxylate

Product 1

HCID 595596032-(Piperazine-1-carbonyl)-benzoic acid methyl ester

Sources & evidence

ORD record
ord-f5c9fa865ab54b81b9307ba6013c601e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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