1,2-Dichloroethane → HCID 178488469, compound

HRID 1537938Notes

Reaction equation

HRID 1537938 reaction equation
[C:50](=[O:51])([OH:52])[O-:53].[CH2:66]([Cl:67])[CH2:68][Cl:69].[CH3:11][O:12][c:13]1[cH:14][c:15]([CH:16]=[C:17]2[C:18](=[O:36])[N:19]3[CH:20]([c:27]4[cH:28][cH:29][c:30]([C:31](=[O:32])[OH:33])[cH:34][cH:35]4)[CH2:21][CH2:22][CH2:23][CH:24]3[CH2:25][CH2:26]2)[cH:37][cH:38][c:39]1-[n:40]1[cH:41][n:42][c:43]([CH3:45])[cH:44]1.[CH3:46][NH:47][CH3:48].[CH3:60][CH2:61][O:62][C:63](=[O:64])[CH3:65].[Na+:54].[O:55]=[CH:56][N:57]([CH3:58])[CH3:59].[OH2:49].[OH:1][n:2]1[c:3]2[c:4]([cH:5][cH:6][cH:7][cH:8]2)[n:9][n:10]1>>[CH3:11][O:12][c:13]1[cH:14][c:15]([CH:16]=[C:17]2[C:18](=[O:36])[N:19]3[CH:20]([c:27]4[cH:28][cH:29][c:30]([C:31](=[O:33])[N:47]([CH3:46])[CH3:48])[cH:34][cH:35]4)[CH2:21][CH2:22][CH2:23][CH:24]3[CH2:25][CH2:26]2)[cH:37][cH:38][c:39]1-[n:40]1[cH:41][n:42][c:43]([CH3:45])[cH:44]1

Participants

10

Reactant 9

HCID 111,2-DichloroethaneHCID 674DimethylamineHCID 769Bicarbonate IonHCID 923Sodium ionHCID 962WaterHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 757711-HydroxybenzotriazoleHCID 178488470HCID 178488470, compound

Product 1

HCID 178488469HCID 178488469, compound

Sources & evidence

ORD record
ord-24a656f1730c4b5eb94ec1e0a4b344cc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

Loading…