Hydrogen Bromide → (5-Amino-4-benzyl-3-n-butoxybenzyl)dimethylamine

HRID 170204Notes

Reaction equation

HRID 170204 reaction equation
[BrH:1].[BrH:27].[CH2:22]([NH2:23])[CH2:24][CH2:25][CH3:26].[CH3:49][NH:50][CH3:51].[NH2:28][c:29]1[c:30]([CH2:42][c:43]2[cH:44][cH:45][cH:46][cH:47][cH:48]2)[c:31]([O:37][CH2:38][CH2:39][CH2:40][CH3:41])[cH:32][c:33]([CH2:34][Br:35])[cH:36]1.[NH2:2][c:3]1[cH:4][c:5]([CH2:20][Br:21])[cH:6][c:7]([S:8](=[O:9])(=[O:10])[NH2:11])[c:12]1[CH2:13][c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1>>[NH2:28][c:29]1[c:30]([CH2:42][c:43]2[cH:44][cH:45][cH:46][cH:47][cH:48]2)[c:31]([O:37][CH2:38][CH2:39][CH2:40][CH3:41])[cH:32][c:33]([CH2:34][N:50]([CH3:49])[CH3:51])[cH:36]1

Participants

6

Reactant 5

HCID 260Hydrogen Bromide2×HCID 674DimethylamineHCID 8007ButylamineHCID 202945383-Amino-2-benzyl-5-(bromomethyl)benzenesulfonamideHCID 538283442-Benzyl-5-(bromomethyl)-3-butoxyaniline

Product 1

HCID 20294557(5-Amino-4-benzyl-3-n-butoxybenzyl)dimethylamine

Sources & evidence

ORD record
ord-6efa48d939f94cab8e150b7f9a2bc960
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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