1,4-Dioxane → HCID 178488801, compound

HRID 170798Notes

Reaction equation

HRID 170798 reaction equation
[NH2:1][c:2]1[n:3][cH:4][c:5]([CH2:9][c:10]2[cH:11][c:12]([O:19][CH3:20])[c:13]([Br:18])[c:14]([O:16][CH3:17])[cH:15]2)[c:6]([NH2:8])[n:7]1.[O:32]1[CH2:33][CH2:34][O:35][CH2:36][CH2:37]1.[OH:21][O:22][C:23]([c:24]1[cH:25][c:26]([Cl:27])[cH:28][cH:29][cH:30]1)=[O:31]>>[NH2:1][c:2]1[n+:3]([O-:21])[cH:4][c:5]([CH2:9][c:10]2[cH:11][c:12]([O:19][CH3:20])[c:13]([Br:18])[c:14]([O:16][CH3:17])[cH:15]2)[c:6]([NH2:8])[n:7]1

Participants

4

Reactant 3

HCID 312751,4-DioxaneHCID 68760BrodimoprimHCID 70297m-Chloroperbenzoic acid

Product 1

HCID 178488801HCID 178488801, compound

Sources & evidence

ORD record
ord-af6c7c05e6d64a4a9f1ffbe865dd6cc3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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