Chloride → Benzene, (chloroethynyl)-

HRID 1114258Notes

Reaction equation

HRID 1114258 reaction equation
[C:15]([Cl:16])([Cl:17])([Cl:18])[Cl:19].[C:9](=[O:10])([O-:11])[O-:12].[CH2:22]([N+:23]([CH2:24][CH2:25][CH2:26][CH3:27])([CH2:28][CH2:29][CH2:30][CH3:31])[CH2:32][CH2:33][CH2:34][CH3:35])[CH2:36][CH2:37][CH3:38].[Cl-:21].[Cs+:13].[Cs+:14].[OH2:20].[c:1]1([C:7]#[CH:8])[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([C:7]#[C:8][Cl:16])[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

8

Reactant 7

HCID 312ChlorideHCID 962WaterHCID 5943Carbon TetrachlorideHCID 10821PhenylacetyleneHCID 16028TetrabutylammoniumHCID 19660Carbonate IonHCID 104967Cesium cation2×

Product 1

HCID 137029Benzene, (chloroethynyl)-

Sources & evidence

ORD record
ord-9611ba3f157047e6a81939ec594ff9f5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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