Hydrogen Bromide → HCID 24889068, compound

HRID 701648Notes

Reaction equation

HRID 701648 reaction equation
[BrH:35].[C:1]12([CH2:11][C:12](=[O:13])[OH:14])[CH2:2][CH:3]3[CH2:4][CH:5]([CH2:6][CH:7]([CH2:8]1)[CH2:9]3)[CH2:10]2.[CH3:36][O:37][CH2:38][CH2:39][n:40]1[c:41](=[NH:45])[s:42][cH:43][cH:44]1.[CH3:46][C:47]([N:48]([CH3:49])[CH3:50])=[O:51].[CH:26]([N:27]([CH2:28][CH3:29])[CH:30]([CH3:31])[CH3:32])([CH3:33])[CH3:34].[OH2:15].[OH:16][n:17]1[c:18]2[cH:19][cH:20][cH:21][cH:22][c:23]2[n:24][n:25]1>>[C:1]12([CH2:11][C:12](=[O:14])[N:45]=[c:41]3[n:40]([CH2:39][CH2:38][O:37][CH3:36])[cH:44][cH:43][s:42]3)[CH2:2][CH:3]3[CH2:4][CH:5]([CH2:6][CH:7]([CH2:8]1)[CH2:9]3)[CH2:10]2

Participants

8

Reactant 7

HCID 260Hydrogen BromideHCID 962WaterHCID 31374DimethylacetamideHCID 757711-HydroxybenzotriazoleHCID 81531DiisopropylethylamineHCID 1232211-Adamantaneacetic acidHCID 66860917HCID 66860917, compound

Product 1

HCID 24889068HCID 24889068, compound

Sources & evidence

ORD record
ord-e2f1a56f6b5e441ca608910b99daf935
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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