Ethanol → 1-Ethylisoquinoline

HRID 2029505Notes

Reaction equation

HRID 2029505 reaction equation
OS(O)(=O)=O.[CH3:1][CH2:2]O.[cH:3]1[cH:12][c:11]([c:6]2[cH:5][cH:4]1)[cH:10][cH:9][n:8][cH:7]2>>[CH3:1][CH2:2][c:7]1[c:6]([c:11]2[cH:10][cH:9][n:8]1)[cH:5][cH:4][cH:3][cH:12]2

Participants

7

Reactant 3

HCID 702EthanolHCID 1118Sulfuric AcidHCID 8405Isoquinoline

Product 1

HCID 5936861-Ethylisoquinoline

Reagents, catalysts & solvents 3

HCID 519709Ethyl 2-mercaptopropionateReagentHCID 6342AcetonitrileSolventHCID 117669-PhenylanthraceneInternal standard

Conditions

Temperature
25 °C

Sources & evidence

ORD record
ord-323dc85c1a1e4164af480477ec147e06
Source dataset
39k HTE dataset from Pfizer
Original link
View source

Reaction notes

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