Dimethyl Sulfoxide → Hydrochloric Acid

HRID 1126162Notes

Reaction equation

HRID 1126162 reaction equation
[C:15](=[O:16])([O-:17])[O-:18].[CH3:31][C:32]#[N:33].[CH3:35][S:36]([CH3:37])=[O:38].[Cl:1][c:2]1[n:3][c:4]2[c:9]([cH:10][cH:11]1)[C:8](=[O:12])[CH2:7][C:6]([CH3:13])([CH3:14])[CH2:5]2.[H-:29].[K+:19].[K+:20].[NH2:21][CH2:22][c:23]1[cH:24][cH:25][cH:26][cH:27][cH:28]1.[Na+:30].[OH2:34]>>[ClH:1].[c:2]1([NH:21][CH2:22][c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[n:3][c:4]2[c:9]([cH:10][cH:11]1)[C:8](=[O:12])[CH2:7][C:6]([CH3:13])([CH3:14])[CH2:5]2

Participants

11

Reactant 9

HCID 679Dimethyl SulfoxideHCID 813Potassium Cation2×HCID 923Sodium ionHCID 962WaterHCID 6342AcetonitrileHCID 7504BenzylamineHCID 19660Carbonate IonHCID 166653HydrideHCID 148125452-Chloro-7,7-dimethyl-7,8-dihydroquinolin-5(6H)-one

Product 2

HCID 313Hydrochloric AcidHCID 247774442-Benzylamino-7,7-dimethyl-7,8-dihydro-6h-quinolin-5-one

Sources & evidence

ORD record
ord-83e964cf641f4e208c489002f28333a5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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