Dichloromethane → (Piperazin-1-yl)acetonitrile

HRID 670639Notes

Reaction equation

HRID 670639 reaction equation
[C:1]([O:2][C:3](=[O:4])[N:8]1[CH2:9][CH2:10][N:11]([CH2:14][C:15]#[N:16])[CH2:12][CH2:13]1)([CH3:5])([CH3:6])[CH3:7].[Cl:24][CH2:25][Cl:26].[F:17][C:18]([F:19])([F:20])[C:21]([OH:22])=[O:23]>>[NH:8]1[CH2:9][CH2:10][N:11]([CH2:14][C:15]#[N:16])[CH2:12][CH2:13]1

Participants

4

Reactant 3

HCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 21936030Tert-butyl 4-(cyanomethyl)piperazine-1-carboxylate

Product 1

HCID 15522031(Piperazin-1-yl)acetonitrile

Sources & evidence

ORD record
ord-b6667176734841c68cce3d65b66fe339
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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