Dichloromethane → Trifluoroacetic acid

HRID 2151120Notes

Reaction equation

HRID 2151120 reaction equation
[C:1]([O:2][C:3](=[O:4])[N:8]1[CH:9]([CH2:13][n:14]2[c:15]([CH3:36])[c:16]([C:27]([NH:28][CH:29]3[CH2:30][CH2:31][CH2:32][CH2:33][CH2:34]3)=[O:35])[cH:17][c:18]2-[c:19]2[c:20]([F:26])[cH:21][cH:22][c:23]([Cl:25])[cH:24]2)[CH2:10][CH2:11][CH2:12]1)([CH3:5])([CH3:6])[CH3:7].[CH2:44]([Cl:45])[Cl:46].[F:37][C:38]([C:39](=[O:40])[OH:41])([F:42])[F:43]>>[F:37][C:38]([C:39](=[O:40])[OH:41])([F:42])[F:43].[NH:8]1[CH:9]([CH2:13][n:14]2[c:15]([CH3:36])[c:16]([C:27]([NH:28][CH:29]3[CH2:30][CH2:31][CH2:32][CH2:33][CH2:34]3)=[O:35])[cH:17][c:18]2-[c:19]2[c:20]([F:26])[cH:21][cH:22][c:23]([Cl:25])[cH:24]2)[CH2:10][CH2:11][CH2:12]1

Participants

5

Reactant 3

HCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 116920862-[5-(5-Chloro-2-fluoro-phenyl)-3-cyclohexylcarbamoyl-2-methyl-pyrrol-1-ylmethyl]-pyrrolidine-1-carboxylic acid tert-butyl ester

Product 2

HCID 6422Trifluoroacetic acidHCID 115482775-(5-chloro-2-fluorophenyl)-N-cyclohexyl-2-methyl-1-(pyrrolidin-2-ylmethyl)pyrrole-3-carboxamide

Sources & evidence

ORD record
ord-52814a47734440ad948489c15bc32d23
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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