Hydrochloric Acid → (3,4-Dimethyl-phenyl)-[2-(6-trifluoromethyl-pyridin-3-yl)-ethyl]-amine

HRID 320624Notes

Reaction equation

HRID 320624 reaction equation
[BH3:60].[CH3:15][c:16]1[cH:17][cH:18][c:19]([NH2:20])[cH:21][c:22]1[CH3:23].[CH3:35][N:36]([CH3:37])[CH2:38][CH2:39][CH2:40][N:41]=[C:42]=[N:43][CH2:44][CH3:45].[CH3:65][CH2:66][O:67][C:68](=[O:69])[CH3:70].[CH:46]([N:47]([CH2:48][CH3:49])[CH:50]([CH3:51])[CH3:52])([CH3:53])[CH3:54].[Cl:62][CH2:63][Cl:64].[ClH:34].[ClH:61].[F:1][C:2]([c:3]1[cH:4][cH:5][c:6]([CH2:9][C:10]([OH:11])=[O:12])[cH:7][n:8]1)([F:13])[F:14].[O:55]1[CH2:56][CH2:57][CH2:58][CH2:59]1.[OH:24][n:25]1[c:26]2[cH:27][cH:28][cH:29][cH:30][c:31]2[n:32][n:33]1>>[F:1][C:2]([c:3]1[cH:4][cH:5][c:6]([CH2:9][CH2:10][NH:20][c:19]2[cH:18][cH:17][c:16]([CH3:15])[c:22]([CH3:23])[cH:21]2)[cH:7][n:8]1)([F:13])[F:14]

Participants

11

Reactant 10

HCID 313Hydrochloric Acid2×HCID 6331BoraneHCID 6344DichloromethaneHCID 72483,4-DimethylanilineHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 757711-HydroxybenzotriazoleHCID 81531DiisopropylethylamineHCID 516957092-(6-(Trifluoromethyl)pyridin-3-yl)acetic acid

Product 1

HCID 58007591(3,4-Dimethyl-phenyl)-[2-(6-trifluoromethyl-pyridin-3-yl)-ethyl]-amine

Sources & evidence

ORD record
ord-0a5a29da812f4f5889e7555ec87db5bd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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