Bicarbonate Ion → 1-[(2-Chloro-4-fluorophenyl)carbonyl]-5-(ethyloxy)-1,2,3,6-tetrahydropyrazine

HRID 2153810Notes

Reaction equation

HRID 2153810 reaction equation
[B-:18]([F:19])([F:20])([F:21])[F:22].[C:31](=[O:32])([O-:33])[OH:34].[CH2:23]([CH3:24])[O+:25]([CH2:26][CH3:27])[CH2:28][CH3:29].[Cl:1][c:2]1[c:3]([C:9](=[O:10])[N:11]2[CH2:12][C:13](=[O:17])[NH:14][CH2:15][CH2:16]2)[cH:4][cH:5][c:6]([F:8])[cH:7]1.[Cl:36][CH2:37][Cl:38].[Na+:35].[OH2:30]>>[Cl:1][c:2]1[c:3]([C:9](=[O:10])[N:11]2[CH2:12][C:13]([O:17][CH2:23][CH3:24])=[N:14][CH2:15][CH2:16]2)[cH:4][cH:5][c:6]([F:8])[cH:7]1

Participants

8

Reactant 7

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 962WaterHCID 6344DichloromethaneHCID 26255TetrafluoroborateHCID 165095TriethyloxoniumHCID 25537116HCID 25537116, compound

Product 1

HCID 665994581-[(2-Chloro-4-fluorophenyl)carbonyl]-5-(ethyloxy)-1,2,3,6-tetrahydropyrazine

Sources & evidence

ORD record
ord-487b0b53b2964a3c8e393ff6de4ac208
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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