Benzene → HCID 11426724, compound

HRID 2344278Notes

Reaction equation

HRID 2344278 reaction equation
[C:1](=[O:2])([O-:3])[O-:4].[CH3:31][CH2:32][CH2:33][CH2:34][CH2:35][CH3:36].[CH3:43][S:44]([CH3:45])=[O:46].[K+:5].[K+:6].[OH2:47].[c:7]1([CH2:13][CH2:14][CH2:15][NH2:16])[cH:8][cH:9][cH:10][cH:11][cH:12]1.[cH:17]1[c:18]([O:27][CH2:28][CH2:29][Cl:30])[cH:19][cH:20][c:21]2[cH:22][cH:23][cH:24][cH:25][c:26]12.[cH:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1>>[c:7]1([CH2:13][CH2:14][CH2:15][NH:16][CH2:29][CH2:28][O:27][c:18]2[cH:17][c:26]3[c:21]([cH:20][cH:19]2)[cH:22][cH:23][cH:24][cH:25]3)[cH:8][cH:9][cH:10][cH:11][cH:12]1

Participants

9

Reactant 8

HCID 241BenzeneHCID 679Dimethyl SulfoxideHCID 813Potassium Cation2×HCID 962WaterHCID 8058HexaneHCID 162593-PhenylpropylamineHCID 19660Carbonate IonHCID 3498772-(2-Naphthyloxy)-1-chloroethane

Product 1

HCID 11426724HCID 11426724, compound

Sources & evidence

ORD record
ord-1924eb0e69024b33a30d65e7ec8c04c3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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