1,2-Dichloroethane → HCID 59143428, compound

HRID 2335328Notes

Reaction equation

HRID 2335328 reaction equation
[CH2:20]([Cl:21])[CH2:22][Cl:23].[CH3:48][N:49]([c:50]1[cH:51][cH:52][n:53][cH:54][cH:55]1)[CH3:56].[CH:24]([CH3:25])([CH2:26][CH3:27])[c:28]1[n:29][o:30][c:31]([NH:33][C:34](=[O:35])[N:36]2[CH2:37][CH2:38][NH:39][CH2:40][CH2:41][CH2:42]2)[cH:32]1.[O:1]1[CH2:2][CH2:3][CH:4]([C:7](=[O:8])[OH:9])[CH2:5][CH2:6]1.[O:43]=[CH:44][N:45]([CH3:46])[CH3:47].[OH2:57].[OH:10][n:11]1[c:12]2[c:13]([cH:14][cH:15][cH:16][cH:17]2)[n:18][n:19]1>>[O:1]1[CH2:2][CH2:3][CH:4]([C:7](=[O:9])[N:39]2[CH2:38][CH2:37][N:36]([C:34]([NH:33][c:31]3[o:30][n:29][c:28]([CH:24]([CH3:25])[CH2:26][CH3:27])[cH:32]3)=[O:35])[CH2:42][CH2:41][CH2:40]2)[CH2:5][CH2:6]1

Participants

8

Reactant 7

HCID 111,2-DichloroethaneHCID 962WaterHCID 6228DimethylformamideHCID 142844-(Dimethylamino)pyridineHCID 757711-HydroxybenzotriazoleHCID 219302Oxane-4-carboxylic acidHCID 59143414HCID 59143414, compound

Product 1

HCID 59143428HCID 59143428, compound

Sources & evidence

ORD record
ord-aa64b74f090642e2a1ed5a449ec88629
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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