1,2-Dichloroethane → HCID 178522660, compound

HRID 140338Notes

Reaction equation

HRID 140338 reaction equation
[CH2:64]([Cl:65])[CH2:66][Cl:67].[CH:1]1([n:7]2[n:8][c:9]([CH2:23][c:24]3[cH:25][cH:26][c:27]([C:28](=[O:29])[OH:30])[cH:31][cH:32]3)[cH:10][c:11]2-[c:12]2[cH:13][cH:14][c:15]([O:18][C:19]([F:20])([F:21])[F:22])[cH:16][cH:17]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[CH:50]([N:51]([CH2:52][CH3:53])[CH:54]([CH3:55])[CH3:56])([CH3:57])[CH3:58].[NH2:44][c:45]1[n:46][n:47][n:48][nH:49]1.[O:59]=[CH:60][N:61]([CH3:62])[CH3:63].[OH2:43].[OH:33][n:34]1[c:35]2[c:36]([cH:37][cH:38][cH:39][cH:40]2)[n:41][n:42]1>>[CH:1]1([n:7]2[n:8][c:9]([CH2:23][c:24]3[cH:25][cH:26][c:27]([C:28](=[O:30])[NH:44][c:45]4[n:46][n:47][n:48][nH:49]4)[cH:31][cH:32]3)[cH:10][c:11]2-[c:12]2[cH:13][cH:14][c:15]([O:18][C:19]([F:20])([F:21])[F:22])[cH:16][cH:17]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1

Participants

8

Reactant 7

HCID 111,2-DichloroethaneHCID 962WaterHCID 6228DimethylformamideHCID 757711-HydroxybenzotriazoleHCID 81531DiisopropylethylamineHCID 67335173HCID 67335173, compoundHCID 178509299HCID 178509299, compound

Product 1

HCID 178522660HCID 178522660, compound

Sources & evidence

ORD record
ord-378d37f040c2489b9721df462cd36d85
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

Loading…