1,2-Dichloroethane → HCID 59505125, compound

HRID 1117804Notes

Reaction equation

HRID 1117804 reaction equation
[CH2:53]([Cl:54])[CH2:55][Cl:56].[CH3:33][c:34]1[n:35][cH:36][o:37][c:38]1[C:39]1([NH2:42])[CH2:40][CH2:41]1.[Cl:58][CH2:59][Cl:60].[ClH:57].[F:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[o:9][c:10]3[c:11]([c:12]2[C:13]([NH:14][CH3:15])=[O:16])[cH:17][c:18](-[c:21]2[c:22]([CH3:32])[cH:23][c:24]([O:30][CH3:31])[c:25]([C:26](=[O:27])[OH:28])[cH:29]2)[cH:19][cH:20]3)[cH:6][cH:7]1.[OH:43][n:44]1[c:45]2[c:46]([cH:47][cH:48][cH:49][cH:50]2)[n:51][n:52]1>>[F:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[o:9][c:10]3[c:11]([c:12]2[C:13]([NH:14][CH3:15])=[O:16])[cH:17][c:18](-[c:21]2[c:22]([CH3:32])[cH:23][c:24]([O:30][CH3:31])[c:25]([C:26](=[O:28])[NH:42][C:39]4([c:38]5[c:34]([CH3:33])[n:35][cH:36][o:37]5)[CH2:40][CH2:41]4)[cH:29]2)[cH:19][cH:20]3)[cH:6][cH:7]1

Participants

7

Reactant 6

HCID 111,2-DichloroethaneHCID 313Hydrochloric AcidHCID 6344DichloromethaneHCID 757711-HydroxybenzotriazoleHCID 592756045-(2-(4-Fluorophenyl)-3-(methylcarbamoyl)benzofuran-5-yl)-2-methoxy-4-methylbenzoic acidHCID 67291710HCID 67291710, compound

Product 1

HCID 59505125HCID 59505125, compound

Sources & evidence

ORD record
ord-baa4519e9fee47918e0c51153bc5325e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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