Isopropanol → Chloride

HRID 662762Notes

Reaction equation

HRID 662762 reaction equation
[CH3:1][N:2]([CH2:3][CH2:4][CH2:5][NH:6][CH:7]=[O:8])[CH3:9].[CH:26]([OH:27])([CH3:28])[CH3:29].[Cl:10][CH2:11][C:12](=[O:13])[NH:14][c:15]1[c:16]([O:24][CH3:25])[cH:17][cH:18][c:19]([N+:21](=[O:22])[O-:23])[cH:20]1>>[CH3:1][N+:2]([CH2:3][CH2:4][CH2:5][NH:6][CH:7]=[O:8])([CH3:9])[CH2:11][C:12](=[O:13])[NH:14][c:15]1[c:16]([O:24][CH3:25])[cH:17][cH:18][c:19]([N+:21](=[O:22])[O-:23])[cH:20]1.[Cl-:10]

Participants

5

Reactant 3

HCID 3776IsopropanolHCID 80020N-(3-(dimethylamino)propyl)formamideHCID 23626032-chloro-N-(2-methoxy-5-nitrophenyl)acetamide

Product 2

HCID 312ChlorideHCID 867330143-Formamidopropyl-[2-(2-methoxy-5-nitroanilino)-2-oxoethyl]-dimethylazanium

Sources & evidence

ORD record
ord-6e659f48f6f94b1b853f2446b6a9ff85
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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