1,2-Dichloroethane → HCID 178423792, compound

HRID 1550712Notes

Reaction equation

HRID 1550712 reaction equation
[CH2:29]([Cl:30])[CH2:31][Cl:32].[CH3:20][c:21]1[n:22][o:23][c:24]([CH:26]([CH3:27])[NH2:28])[n:25]1.[CH:43]([N:44]([CH:45]([CH3:46])[CH3:47])[CH2:48][CH3:49])([CH3:50])[CH3:51].[ClH:19].[F:1][c:2]1[c:3](-[c:9]2[cH:10][n+:11]([O-:18])[cH:12][c:13]([C:14](=[O:15])[OH:16])[cH:17]2)[cH:4][cH:5][c:6]([CH3:8])[cH:7]1.[O:52]=[CH:53][N:54]([CH3:55])[CH3:56].[OH:33][n:34]1[c:35]2[c:36]([cH:37][cH:38][cH:39][cH:40]2)[n:41][n:42]1>>[F:1][c:2]1[c:3](-[c:9]2[cH:10][n+:11]([O-:18])[cH:12][c:13]([C:14](=[O:16])[NH:28][CH:26]([c:24]3[o:23][n:22][c:21]([CH3:20])[n:25]3)[CH3:27])[cH:17]2)[cH:4][cH:5][c:6]([CH3:8])[cH:7]1

Participants

8

Reactant 7

HCID 111,2-DichloroethaneHCID 313Hydrochloric AcidHCID 6228DimethylformamideHCID 757711-HydroxybenzotriazoleHCID 81531DiisopropylethylamineHCID 431068281-(3-Methyl-1,2,4-oxadiazol-5-yl)ethanamineHCID 673383365-(2-Fluoro-4-methylphenyl)nicotinic acid 1-oxide

Product 1

HCID 178423792HCID 178423792, compound

Sources & evidence

ORD record
ord-59a8f4d9202349018ba6052d2f56e01f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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