1,2-Dichloroethane → HCID 68469530, compound

HRID 169742Notes

Reaction equation

HRID 169742 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][CH2:6][CH:7]1[N:8]([CH3:40])[C:9](=[N:12][c:13]2[cH:14][c:15]3[c:16]([NH:23][c:24]4[cH:25][c:26]([Cl:39])[c:27]([CH2:30][O:31][c:32]5[cH:33][c:34]([F:38])[cH:35][cH:36][cH:37]5)[cH:28][cH:29]4)[n:17][cH:18][n:19][c:20]3[cH:21][cH:22]2)[O:10][CH2:11]1.[CH2:48]([Cl:49])[Cl:50].[Cl:51][CH2:52][CH2:53][Cl:54].[F:41][C:42]([F:43])([F:44])[C:45]([OH:46])=[O:47]>>[OH:5][CH2:6][CH:7]1[N:8]([CH3:40])[C:9](=[N:12][c:13]2[cH:14][c:15]3[c:16]([NH:23][c:24]4[cH:25][c:26]([Cl:39])[c:27]([CH2:30][O:31][c:32]5[cH:33][c:34]([F:38])[cH:35][cH:36][cH:37]5)[cH:28][cH:29]4)[n:17][cH:18][n:19][c:20]3[cH:21][cH:22]2)[O:10][CH2:11]1

Participants

5

Reactant 4

HCID 111,2-DichloroethaneHCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 68466705HCID 68466705, compound

Product 1

HCID 68469530HCID 68469530, compound

Sources & evidence

ORD record
ord-7bc9b871976b4ce9b1f7d3a609fa1650
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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