4-Fluoroaniline → 1,5-Bis-(4-fluoro-phenyl)-2-methyl-1H-pyrrole-3-carboxylic acid ethyl ester

HRID 1141034Notes

Reaction equation

HRID 1141034 reaction equation
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[c:7]([CH3:24])[n:8](-[c:18]2[cH:19][cH:20][cH:21][cH:22][cH:23]2)[c:9](-[c:11]2[cH:12][cH:13][c:14]([F:17])[cH:15][cH:16]2)[cH:10]1.[CH2:25]([O:26][C:27](=[O:28])[CH:29]([CH2:30][C:31]([c:32]1[cH:33][cH:34][c:35]([F:42])[cH:36][cH:37]1)=[O:38])[C:39](=[O:40])[CH3:41])[CH3:43].[NH2:44][c:45]1[cH:46][cH:47][c:48]([F:49])[cH:50][cH:51]1>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[c:7]([CH3:24])[n:8](-[c:18]2[cH:19][cH:20][c:21]([F:42])[cH:22][cH:23]2)[c:9](-[c:11]2[cH:12][cH:13][c:14]([F:17])[cH:15][cH:16]2)[cH:10]1

Participants

4

Reactant 3

HCID 97314-FluoroanilineHCID 141739732-Acetyl-4-(4-fluorophenyl)-4-oxobutyric acid ethyl esterHCID 143391945-(4-Fluoro-phenyl)-2-methyl-1-phenyl-1H-pyrrole-3-carboxylic acid ethyl ester

Product 1

HCID 143391951,5-Bis-(4-fluoro-phenyl)-2-methyl-1H-pyrrole-3-carboxylic acid ethyl ester

Sources & evidence

ORD record
ord-98f36ec58c8e48c09ebdbef18d1746c2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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