Ammonium → 3,5-dimethyl-N-(1-phenylethyl)aniline

HRID 165633

Reaction equation

HRID 165633 reaction equation
[Br:23][c:24]1[cH:25][c:26]([CH3:31])[cH:27][c:28]([CH3:30])[cH:29]1.[CH2:1]([N:2]([CH2:3][CH3:4])[C:5](=[O:6])[c:7]1[c:8]([OH:13])[cH:9][cH:10][cH:11][cH:12]1)[CH3:14].[CH3:32][CH:33]([c:34]1[cH:35][cH:36][cH:37][cH:38][cH:39]1)[NH2:40].[CH3:43][CH2:44][CH2:45][CH2:46][CH2:47][CH2:48][CH2:49][CH2:50][CH2:51][CH2:52][CH2:53][CH3:54].[CH3:56][CH2:57][O:58][C:59](=[O:60])[CH3:61].[K+:20].[K+:21].[K+:22].[NH4+:41].[O:62]=[CH:63][N:64]([CH3:65])[CH3:66].[OH-:42].[OH2:55].[P:15]([O-:16])([O-:17])([O-:18])=[O:19]>>[c:24]1([NH:40][CH:33]([CH3:32])[c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)[cH:25][c:26]([CH3:31])[cH:27][c:28]([CH3:30])[cH:29]1

Participants

12

Reactant 11

HCID 223AmmoniumHCID 813Potassium Cation3×HCID 961HydroxideHCID 962WaterHCID 1061PhosphateHCID 6228DimethylformamideHCID 74081-PhenethylamineHCID 8182DodecaneHCID 8857Ethyl AcetateHCID 88006DiethylsalicylamideHCID 136357Benzene, 1-bromo-3,5-dimethyl-

Product 1

HCID 219406823,5-dimethyl-N-(1-phenylethyl)aniline

Sources & evidence

ORD record
ord-b8f5d6fd47334c03891cc10a321cc56f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

Loading…