1,2-Dichloroethane → 2-Chloro-1-[5-(4-nitrobenzoyl)-1-methyl-1H-pyrrol-3-yl]-ethanone

HRID 694638Notes

Reaction equation

HRID 694638 reaction equation
[Al+3:2].[CH3:5][n:6]1[c:7]([C:11](=[O:12])[c:13]2[cH:14][cH:15][c:16]([N+:19](=[O:20])[O-:21])[cH:17][cH:18]2)[cH:8][cH:9][cH:10]1.[Cl-:1].[Cl-:3].[Cl-:4].[Cl:22][CH2:23][C:24](=[O:25])[Cl:26].[Cl:28][CH2:29][CH2:30][Cl:31].[ClH:27]>>[CH3:5][n:6]1[c:7]([C:11](=[O:12])[c:13]2[cH:14][cH:15][c:16]([N+:19](=[O:20])[O-:21])[cH:17][cH:18]2)[cH:8][c:9]([C:24]([CH2:23][Cl:22])=[O:25])[cH:10]1

Participants

7

Reactant 6

HCID 111,2-DichloroethaneHCID 312Chloride3×HCID 313Hydrochloric AcidHCID 6577Chloroacetyl chlorideHCID 104727Aluminum CationHCID 2308030(1-Methyl-1H-pyrrol-2-yl)(4-nitrophenyl)methanone

Product 1

HCID 108046192-Chloro-1-[5-(4-nitrobenzoyl)-1-methyl-1H-pyrrol-3-yl]-ethanone

Sources & evidence

ORD record
ord-9233019eb2094067b00640e4544fa2d9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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