Isopropanol → 4-(5-Bromobenzoxazol-2-yl)-1,4-diazabicyclo[3.2.2]nonane

HRID 320943Notes

Reaction equation

HRID 320943 reaction equation
[Br:10][c:11]1[cH:12][cH:13][c:14]2[c:15]([n:16][c:17]([S:19][CH3:20])[o:18]2)[cH:21]1.[CH:22]([OH:23])([CH3:24])[CH3:25].[N:1]12[CH2:2][CH2:3][NH:4][CH:5]([CH2:6][CH2:7]1)[CH2:8][CH2:9]2>>[N:1]12[CH2:2][CH2:3][N:4]([c:17]3[n:16][c:15]4[c:14]([cH:13][cH:12][c:11]([Br:10])[cH:21]4)[o:18]3)[CH:5]([CH2:6][CH2:7]1)[CH2:8][CH2:9]2

Participants

4

Reactant 3

HCID 3776IsopropanolHCID 3984071,4-Diazabicyclo(3.2.2)nonaneHCID 224957925-Bromo-2-(methylthio)benzo[d]oxazole

Product 1

HCID 224957824-(5-Bromobenzoxazol-2-yl)-1,4-diazabicyclo[3.2.2]nonane

Sources & evidence

ORD record
ord-d11baf14bbf04fadaea03f7de4a4d7db
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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