1,2-Dichloroethane → HCID 75301601, compound

HRID 1217767Notes

Reaction equation

HRID 1217767 reaction equation
[CH2:33]([Cl:34])[CH2:35][Cl:36].[CH3:1][C:2]([CH:3]([C:4](=[O:5])[OH:6])[N:7]1[CH2:8][c:9]2[cH:10][cH:11][n:12][c:13]3[c:14]2[c:15]([cH:18][nH:19]3)[C:16]1=[O:17])([CH3:20])[CH3:21].[CH3:45][N:46]1[CH2:47][CH2:48][O:49][CH2:50][CH2:51]1.[ClH:37].[ClH:38].[NH:39]1[CH2:40][CH:41]([C:43]#[N:44])[CH2:42]1.[O:52]=[CH:53][N:54]([CH3:55])[CH3:56].[OH2:32].[OH:22][n:23]1[c:24]2[c:25]([cH:26][cH:27][cH:28][cH:29]2)[n:30][n:31]1>>[CH3:1][C:2]([CH:3]([C:4](=[O:5])[N:39]1[CH2:40][CH:41]([C:43]#[N:44])[CH2:42]1)[N:7]1[CH2:8][c:9]2[cH:10][cH:11][n:12][c:13]3[c:14]2[c:15]([cH:18][nH:19]3)[C:16]1=[O:17])([CH3:20])[CH3:21]

Participants

9

Reactant 8

HCID 111,2-DichloroethaneHCID 313Hydrochloric Acid2×HCID 962WaterHCID 6228DimethylformamideHCID 79724-MethylmorpholineHCID 757711-HydroxybenzotriazoleHCID 221323843-AzetidinecarbonitrileHCID 76744004HCID 76744004, compound

Product 1

HCID 75301601HCID 75301601, compound

Sources & evidence

ORD record
ord-f06b686bcd804fa7ab154fb48ad143e5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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