1,2-Dichloroethane → HCID 57597100, compound

HRID 317180Notes

Reaction equation

HRID 317180 reaction equation
[CH2:27]([Cl:28])[CH2:29][Cl:30].[CH3:41][CH2:42][N:43]([CH2:44][CH3:45])[CH2:46][CH3:47].[CH3:53][CH2:54][O:55][C:56]([CH3:57])=[O:58].[N+:14](=[O:15])([O-:16])[c:17]1[cH:18][c:19]([CH2:23][C:24](=[O:25])[OH:26])[cH:20][cH:21][cH:22]1.[N:1]1([C:7](=[O:8])[O:9][C:10]([CH3:11])([CH3:12])[CH3:13])[CH2:2][CH2:3][NH:4][CH2:5][CH2:6]1.[O:48]=[CH:49][N:50]([CH3:51])[CH3:52].[OH:31][n:32]1[c:33]2[c:34]([cH:35][cH:36][cH:37][cH:38]2)[n:39][n:40]1>>[N:1]1([C:7](=[O:8])[O:9][C:10]([CH3:11])([CH3:12])[CH3:13])[CH2:2][CH2:3][N:4]([C:24]([CH2:23][c:19]2[cH:18][c:17]([N+:14](=[O:15])[O-:16])[cH:22][cH:21][cH:20]2)=[O:25])[CH2:5][CH2:6]1

Participants

8

Reactant 7

HCID 111,2-DichloroethaneHCID 6228DimethylformamideHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 158763-Nitrophenylacetic acidHCID 757711-HydroxybenzotriazoleHCID 143452tert-Butyl piperazine-1-carboxylate

Product 1

HCID 57597100HCID 57597100, compound

Sources & evidence

ORD record
ord-f8b9b19e190a40149516af9d6e049f6f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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