Dichloromethane → Trifluoroacetic acid

HRID 187465Notes

Reaction equation

HRID 187465 reaction equation
[CH3:8][C:9]([O:10][C:11]([N:15]([C:12]([O:13][C:14]([CH3:16])([CH3:17])[CH3:18])=[O:19])[c:23]1[nH:24][c:25]([C:29](=[O:30])[NH:31][CH2:32][c:33]2[c:34]([F:50])[c:35]([O:40][c:41]3[cH:42][c:43]([Cl:49])[cH:44][c:45]([C:47]#[N:48])[cH:46]3)[c:36]([Cl:39])[cH:37][cH:38]2)[c:26]([Br:28])[n:27]1)=[O:20])([CH3:21])[CH3:22].[Cl:51][CH2:52][Cl:53].[F:1][C:2]([C:3](=[O:4])[OH:5])([F:6])[F:7]>>[F:1][C:2]([C:3](=[O:4])[OH:5])([F:6])[F:7].[NH2:15][c:23]1[nH:24][c:25]([C:29](=[O:30])[NH:31][CH2:32][c:33]2[c:34]([F:50])[c:35]([O:40][c:41]3[cH:42][c:43]([Cl:49])[cH:44][c:45]([C:47]#[N:48])[cH:46]3)[c:36]([Cl:39])[cH:37][cH:38]2)[c:26]([Br:28])[n:27]1

Participants

5

Reactant 3

HCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 178454340HCID 178454340, compound

Product 2

HCID 6422Trifluoroacetic acidHCID 1785099482-amino-4-bromo-N-({4-chloro-3-[(3-chloro-5-cyanophenyl)oxy]-2-fluorophenyl}methyl)-1H-imidazole-5-carboxamide

Sources & evidence

ORD record
ord-c16d5cadc26f4710b2f022686ff0dcd3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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