Perchloric Acid → Perchloric Acid

HRID 1554424Notes

Reaction equation

HRID 1554424 reaction equation
[CH3:19][n:20]1[c:21]([CH2:26][C:27](=[O:28])[O:29][CH3:30])[cH:22][c:23]([CH3:25])[cH:24]1.[CH3:1][N:2]=[C:3]([c:4]1[cH:5][cH:6][c:7]([N+:10](=[O:11])[O-:12])[cH:8][cH:9]1)[Cl:13].[Cl+3:31]([O-:32])([O-:33])([O-:34])[OH:35].[Cl:14][S:15]([OH:16])(=[O:17])=[O:18]>>[CH3:1][N:2]=[C:3]([c:4]1[cH:5][cH:6][c:7]([N+:10](=[O:11])[O-:12])[cH:8][cH:9]1)[c:24]1[n:20]([CH3:19])[c:21]([CH2:26][C:27](=[O:28])[O:29][CH3:30])[cH:22][c:23]1[CH3:25].[Cl+3:31]([O-:32])([O-:33])([O-:34])[OH:35]

Participants

6

Reactant 4

HCID 24247Perchloric AcidHCID 24638Chlorosulfonic acidHCID 12410498N-Methyl 4-Nitrobenzimidoyl ChlorideHCID 13221886Methyl 1,4-dimethyl-1H-pyrrole-2-acetate

Product 2

HCID 24247Perchloric AcidHCID 13221891methyl 2-[1,4-dimethyl-5-[N-methyl-C-(4-nitrophenyl)carbonimidoyl]pyrrol-2-yl]acetate

Sources & evidence

ORD record
ord-9aca05667d864daabb743db80f5877e7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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