1,2-Dichloroethane → HCID 23144647, compound

HRID 208620Notes

Reaction equation

HRID 208620 reaction equation
[CH2:27]([Cl:28])[CH2:29][Cl:30].[CH3:20][C:21]([CH3:22])([OH:23])[C:24]([OH:25])=[O:26].[ClH:31].[O:43]=[CH:44][N:45]([CH3:46])[CH3:47].[OH2:32].[OH2:48].[OH:33][n:34]1[c:35]2[cH:36][cH:37][cH:38][cH:39][c:40]2[n:41][n:42]1.[c:1]1([C:7](=[O:8])[c:9]2[c:10](-[c:15]3[o:16][cH:17][cH:18][cH:19]3)[n:11][c:12]([NH2:14])[s:13]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([C:7](=[O:8])[c:9]2[c:10](-[c:15]3[o:16][cH:17][cH:18][cH:19]3)[n:11][c:12]([NH:14][C:24]([C:21]([CH3:20])([CH3:22])[OH:23])=[O:25])[s:13]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

8

Reactant 7

HCID 111,2-DichloroethaneHCID 313Hydrochloric AcidHCID 962Water2×HCID 6228DimethylformamideHCID 116712-Hydroxyisobutyric acidHCID 757711-HydroxybenzotriazoleHCID 86060929HCID 86060929, compound

Product 1

HCID 23144647HCID 23144647, compound

Sources & evidence

ORD record
ord-e671c19b8ff048a6a0827d20716e14de
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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