Acetic Acid → Elq-300

HRID 677521Notes

Reaction equation

HRID 677521 reaction equation
[BrH:36].[CH3:37][C:38](=[O:39])[OH:40].[Cl:1][c:2]1[cH:3][c:4]2[c:5]([O:33][CH2:34][CH3:35])[c:6](-[c:15]3[cH:16][cH:17][c:18]([O:21][c:22]4[cH:23][cH:24][c:25]([O:28][C:29]([F:30])([F:31])[F:32])[cH:26][cH:27]4)[cH:19][cH:20]3)[c:7]([CH3:14])[n:8][c:9]2[cH:10][c:11]1[O:12][CH3:13]>>[Cl:1][c:2]1[cH:3][c:4]2[c:5](=[O:33])[c:6](-[c:15]3[cH:16][cH:17][c:18]([O:21][c:22]4[cH:23][cH:24][c:25]([O:28][C:29]([F:30])([F:31])[F:32])[cH:26][cH:27]4)[cH:19][cH:20]3)[c:7]([CH3:14])[nH:8][c:9]2[cH:10][c:11]1[O:12][CH3:13]

Participants

4

Reactant 3

HCID 176Acetic AcidHCID 260Hydrogen BromideHCID 670163156-Chloro-4-ethoxy-7-methoxy-2-methyl-3-(4-(4-(trifluoromethoxy)phenoxy)phenyl)quinoline

Product 1

HCID 67016608Elq-300

Sources & evidence

ORD record
ord-87478bfe42c442a1a4abc6e0593c815e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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