Chlorobenzene → 4-Amino-3,5-dichlorobenzotrifluoride

HRID 1135511Notes

Reaction equation

[CH3:25][N:26]1[CH2:27][CH2:28][CH2:29][C:30]1=[O:31].[Cl:13][c:14]1[cH:15][cH:16][c:17]([C:18]([F:19])([F:20])[F:21])[cH:22][c:23]1[NH2:24].[Cl:1][c:2]1[c:3]([NH2:4])[cH:5][cH:6][c:7]([C:9]([F:10])([F:11])[F:12])[cH:8]1.[Cl:37][c:38]1[cH:39][cH:40][cH:41][cH:42][cH:43]1.[S:32]([Cl:33])([Cl:34])(=[O:35])=[O:36]>>[Cl:1][c:2]1[c:3]([NH2:4])[c:5]([Cl:13])[cH:6][c:7]([C:9]([F:10])([F:11])[F:12])[cH:8]1

Participants

Reactant 5

HCID 7964Chlorobenzene

HCID 8475Benzenamine, 2-chloro-5-(trifluoromethyl)-

HCID 13387N-methyl-2-pyrrolidone

HCID 24648Sulfuryl chloride

HCID 1620012-Chloro-4-trifluoromethylaniline

Product 1

HCID 1410944-Amino-3,5-dichlorobenzotrifluoride

Sources & evidence

ORD record: ord-29b6bf7353ec4fbeae2ad6c3b4d1996e
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

Reaction notes

Loading…