1,2-Dichloroethane → HCID 22753277, compound

HRID 105218Notes

Reaction equation

HRID 105218 reaction equation
[Al+3:45].[Cl-:34].[Cl-:44].[Cl-:46].[Cl-:47].[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[s:9][c:10]3[c:11]([cH:12]2)[cH:13][cH:14][cH:15][cH:16]3)[cH:6][cH:7]1.[Cl:50][CH2:51][CH2:52][Cl:53].[N:17]1([CH2:22][CH2:23][O:24][c:25]2[cH:26][cH:27][c:28]([C:29](=[O:30])[OH:31])[cH:32][cH:33]2)[CH2:18][CH2:19][CH2:20][CH2:21]1.[Na+:49].[OH-:48].[s:35]1[c:36]2[cH:37][cH:38][cH:39][cH:40][c:41]2[cH:42][cH:43]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[s:9][c:10]3[c:11]([c:12]2[C:29]([c:28]2[cH:27][cH:26][c:25]([O:24][CH2:23][CH2:22][N:17]4[CH2:18][CH2:19][CH2:20][CH2:21]4)[cH:33][cH:32]2)=[O:30])[cH:13][cH:14][cH:15][cH:16]3)[cH:6][cH:7]1

Participants

9

Reactant 8

HCID 111,2-DichloroethaneHCID 312Chloride4×HCID 923Sodium ionHCID 961HydroxideHCID 7221Benzo(B)ThiopheneHCID 104727Aluminum CationHCID 65042284-(2-Pyrrolidin-1-yl-ethoxy)-benzoic acidHCID 13527233HCID 13527233, compound

Product 1

HCID 22753277HCID 22753277, compound

Sources & evidence

ORD record
ord-1bfe70c4f51644bf8f2b98ba2d577732
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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