Acetonitrile → 5-(2-Chloroethoxy)-1-benzothiophene

HRID 2313886Notes

Reaction equation

HRID 2313886 reaction equation
[C:25](=[O:26])([O-:27])[O-:28].[CH3:31][C:32]#[N:33].[Cl:11][CH2:12][CH2:13][O:14][S:15]([c:16]1[cH:17][cH:18][c:19]([CH3:20])[cH:21][cH:22]1)(=[O:23])=[O:24].[Cs+:29].[Cs+:30].[s:1]1[c:2]2[c:3]([cH:4][cH:5]1)[cH:6][c:7]([OH:10])[cH:8][cH:9]2>>[s:1]1[c:2]2[c:3]([cH:4][cH:5]1)[cH:6][c:7]([O:10][CH2:13][CH2:12][Cl:11])[cH:8][cH:9]2

Participants

6

Reactant 5

HCID 6342AcetonitrileHCID 6639Ethanol, 2-chloro-, 1-(4-methylbenzenesulfonate)HCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 12203499Benzo[b]thiophen-5-ol

Product 1

HCID 574288805-(2-Chloroethoxy)-1-benzothiophene

Sources & evidence

ORD record
ord-43ed34cfbbe94b71bffb0b072aa82748
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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