1,2-Dichloroethane → HCID 57889591, compound

HRID 195739Notes

Reaction equation

HRID 195739 reaction equation
[CH2:20]([Cl:21])[CH2:22][Cl:23].[CH3:59][OH:60].[CH:50]([N:51]([CH2:52][CH3:53])[CH:54]([CH3:55])[CH3:56])([CH3:57])[CH3:58].[ClH:24].[NH2:25][CH:26]([C:27](=[O:28])[N:29]1[CH2:30][CH2:31][CH:32]([c:35]2[cH:36][cH:37][c:38]([Cl:41])[cH:39][cH:40]2)[CH2:33][CH2:34]1)[CH2:42][CH2:43][CH3:44].[O:45]=[CH:46][N:47]([CH3:48])[CH3:49].[OH:11][C:12](=[O:13])[c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1.[OH:1][n:2]1[c:3]2[c:4]([cH:5][cH:6][cH:7][cH:8]2)[n:9][n:10]1>>[C:12](=[O:13])([c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)[NH:25][CH:26]([C:27](=[O:28])[N:29]1[CH2:30][CH2:31][CH:32]([c:35]2[cH:36][cH:37][c:38]([Cl:41])[cH:39][cH:40]2)[CH2:33][CH2:34]1)[CH2:42][CH2:43][CH3:44]

Participants

9

Reactant 8

HCID 111,2-DichloroethaneHCID 243Benzoic AcidHCID 313Hydrochloric AcidHCID 887MethanolHCID 6228DimethylformamideHCID 757711-HydroxybenzotriazoleHCID 81531DiisopropylethylamineHCID 57889336HCID 57889336, compound

Product 1

HCID 57889591HCID 57889591, compound

Sources & evidence

ORD record
ord-104d0ba4cfac457f89eddd4b84386148
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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