1,2-Dichloroethane → HCID 66960108, compound

HRID 2335531Notes

Reaction equation

HRID 2335531 reaction equation
[CH2:53]([Cl:54])[CH2:55][Cl:56].[CH3:46][CH2:47][O:48][C:49](=[O:50])[CH3:51].[CH3:6][O:7][c:8]1[cH:9][c:10]([CH:20]=[CH:21][C:22](=[O:23])[OH:24])[cH:11][cH:12][c:13]1-[n:14]1[cH:15][n:16][c:17]([CH3:19])[cH:18]1.[O:1]=[CH:2][N:3]([CH3:4])[CH3:5].[O:25]1[CH2:26][CH2:27][CH:28]([NH2:35])[c:29]2[cH:30][cH:31][cH:32][cH:33][c:34]21.[OH2:52].[OH:36][n:37]1[c:38]2[c:39]([cH:40][cH:41][cH:42][cH:43]2)[n:44][n:45]1>>[CH3:6][O:7][c:8]1[cH:9][c:10]([CH:20]=[CH:21][C:22](=[O:24])[NH:35][CH:28]2[CH2:27][CH2:26][O:25][c:34]3[c:29]2[cH:30][cH:31][cH:32][cH:33]3)[cH:11][cH:12][c:13]1-[n:14]1[cH:15][n:16][c:17]([CH3:19])[cH:18]1

Participants

8

Reactant 7

HCID 111,2-DichloroethaneHCID 962WaterHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 757711-HydroxybenzotriazoleHCID 49619573,4-Dihydro-2H-1-benzopyran-4-amineHCID 668395163-[3-Methoxy-4-(4-methylimidazol-1-yl)phenyl]prop-2-enoic acid

Product 1

HCID 66960108HCID 66960108, compound

Sources & evidence

ORD record
ord-223beb3888f644efa39cb04e9130fab1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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