Hydrochloric Acid → Hydrochloric Acid

HRID 141629Notes

Reaction equation

HRID 141629 reaction equation
[CH3:31][CH2:32][O:33][CH2:34][CH3:35].[Cl:1][c:2]1[cH:3][c:4]([C:21]#[N:22])[c:5]([C:8]2=[CH:9][CH2:10][N:11]([C:14]([O:15][C:16]([CH3:17])([CH3:18])[CH3:19])=[O:20])[CH2:12][CH2:13]2)[cH:6][cH:7]1.[Cl:36][CH2:37][Cl:38].[ClH:30].[OH:23][C:24]([C:25]([F:26])([F:27])[F:28])=[O:29]>>[Cl:1][c:2]1[cH:3][c:4]([C:21]#[N:22])[c:5]([C:8]2=[CH:9][CH2:10][NH:11][CH2:12][CH2:13]2)[cH:6][cH:7]1.[ClH:30]

Participants

7

Reactant 5

HCID 313Hydrochloric AcidHCID 3283Diethyl EtherHCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 68963760tert-butyl 4-(4-chloro-2-cyanophenyl)-3,6-dihydro-2H-pyridine-1-carboxylate

Product 2

HCID 313Hydrochloric AcidHCID 688927975-Chloro-2-(1,2,3,6-tetrahydropyridin-4-yl)benzonitrile

Sources & evidence

ORD record
ord-81310b7bda454e0286e454f430f7bb9b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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