Potassium Cation → 4-(2-Cyclopropyl-4-methylphenyl)piperazine-1carboxylic acid tert-butyl ester

HRID 213779Notes

Reaction equation

HRID 213779 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][N:11]([c:14]2[c:15]([Cl:21])[cH:16][c:17]([CH3:20])[cH:18][cH:19]2)[CH2:12][CH2:13]1.[CH3:36][c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1.[CH:30]1([B:33]([OH:34])[OH:35])[CH2:31][CH2:32]1.[K+:27].[K+:28].[K+:29].[OH2:43].[P:22]([O-:23])([O-:24])([O-:25])=[O:26]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][N:11]([c:14]2[c:15]([CH:30]3[CH2:31][CH2:32]3)[cH:16][c:17]([CH3:20])[cH:18][cH:19]2)[CH2:12][CH2:13]1

Participants

7

Reactant 6

HCID 813Potassium Cation3×HCID 962WaterHCID 1061PhosphateHCID 1140TolueneHCID 2760897Cyclopropylboronic acidHCID 673810454-(2-Chloro-4-methylphenyl)piperazine-1-carboxylic acid tert-butyl ester

Product 1

HCID 673807494-(2-Cyclopropyl-4-methylphenyl)piperazine-1carboxylic acid tert-butyl ester

Sources & evidence

ORD record
ord-e69a99d1407a46429b1efd2d0a4a0773
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

Loading…