Hydrochloric Acid → 3-{3-[(2-Chloro-3-trifluoromethyl-benzyl)-2,2-diphenylethylamino]-propoxy}-phenylamine

HRID 138538Notes

Reaction equation

HRID 138538 reaction equation
[C:1]([O:2][C:3](=[O:4])[NH:7][c:8]1[cH:9][c:10]([O:14][CH2:15][CH2:16][CH2:17][N:18]([CH2:19][CH:20]([c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[CH2:33][c:34]2[c:35]([Cl:44])[c:36]([C:40]([F:41])([F:42])[F:43])[cH:37][cH:38][cH:39]2)[cH:11][cH:12][cH:13]1)([CH3:5])([CH3:6])[CH3:45].[ClH:46].[O:47]1[CH2:48][CH2:49][O:50][CH2:51][CH2:52]1>>[NH2:7][c:8]1[cH:9][c:10]([O:14][CH2:15][CH2:16][CH2:17][N:18]([CH2:19][CH:20]([c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[CH2:33][c:34]2[c:35]([Cl:44])[c:36]([C:40]([F:41])([F:42])[F:43])[cH:37][cH:38][cH:39]2)[cH:11][cH:12][cH:13]1

Participants

4

Reactant 3

HCID 313Hydrochloric AcidHCID 312751,4-DioxaneHCID 10175511(3-{3-[(2-Chloro-3-trifluoromethyl-benzyl)-diphenylethyl-amino]-propoxy}-phenyl)-carbamic acid tert-butyl ester

Product 1

HCID 101287483-{3-[(2-Chloro-3-trifluoromethyl-benzyl)-2,2-diphenylethylamino]-propoxy}-phenylamine

Sources & evidence

ORD record
ord-16248b65d4024497bb691ad7ee9625ba
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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