Acetic Acid → 1-(2-Bromophenyl)-4-cyclopropylmethylpiperazine

HRID 1573244Notes

Reaction equation

HRID 1573244 reaction equation
[Br:1][c:2]1[c:3]([N:8]2[CH2:9][CH2:10][NH:11][CH2:12][CH2:13]2)[cH:4][cH:5][cH:6][cH:7]1.[C:23]([O:24][BH-:25]([O:26][C:27](=[O:28])[CH3:29])[O:30][C:31](=[O:32])[CH3:33])(=[O:34])[CH3:35].[C:37](=[O:38])([O-:39])[O-:40].[CH3:14][C:15](=[O:16])[OH:17].[CH3:48][CH2:49][O:50][C:51](=[O:52])[CH3:53].[CH:18]1([CH:21]=[O:22])[CH2:19][CH2:20]1.[K+:41].[K+:42].[Na+:36].[O:43]1[CH2:44][CH2:45][CH2:46][CH2:47]1>>[Br:1][c:2]1[c:3]([N:8]2[CH2:9][CH2:10][N:11]([CH2:21][CH:18]3[CH2:19][CH2:20]3)[CH2:12][CH2:13]2)[cH:4][cH:5][cH:6][cH:7]1

Participants

10

Reactant 9

HCID 176Acetic AcidHCID 813Potassium Cation2×HCID 923Sodium ionHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 123114CyclopropanecarboxaldehydeHCID 2724942TriacetoxyborohydrideHCID 27571531-(2-Bromophenyl)piperazine

Product 1

HCID 231428391-(2-Bromophenyl)-4-cyclopropylmethylpiperazine

Sources & evidence

ORD record
ord-261fdd6146c846d7a44260a88ac17f5c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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