Ethanol → 1-Ethylisoquinoline

HRID 2029523Notes

Reaction equation

HRID 2029523 reaction equation
[cH:1]1[cH:10][c:9]([c:4]2[cH:3][cH:2]1)[cH:8][cH:7][n:6][cH:5]2.[CH3:11][CH2:12]O>>[CH3:11][CH2:12][c:5]1[c:4]([c:9]2[cH:8][cH:7][n:6]1)[cH:3][cH:2][cH:1][cH:10]2

Participants

7

Reactant 3

HCID 702EthanolHCID 6422Trifluoroacetic acidHCID 8405Isoquinoline

Product 1

HCID 5936861-Ethylisoquinoline

Reagents, catalysts & solvents 3

HCID 519709Ethyl 2-mercaptopropionateReagentHCID 679Dimethyl SulfoxideSolventHCID 117669-PhenylanthraceneInternal standard

Conditions

Temperature
25 °C

Sources & evidence

ORD record
ord-f5054244878843769eae849c4e08c9bf
Source dataset
39k HTE dataset from Pfizer
Original link
View source

Reaction notes

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